Vitas-M small molecule compound
(8Z)-4-(thiophen-2-yl)-8-(thiophen-2-ylmethylidene)-3,4,5,6,7,8-hexahydroquinazoline-2(1H)-thione
Catalog ID
STK681832
SMILES S=C1NC2=C(C(N1)c1cccs1)CCC/C/2=C/c1cccs1
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We supply compounds in quantities from 1 mg up to 5 g for research and development purposes only.
We do not supply quantities above 5 g.
Structure and other identifiers
2D representation rendered from the SMILES, with core physicochemical data.Formula C17H16N2S3 MW 344.53 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H16N2S3/c20-17-18-15-11(10-12-5-2-8-21-12)4-1-6-13(15)16(19-17)14-7-3-9-22-14/h2-3,5,7-10,16H,1,4,6H2,(H2,18,19,20)/b11-10-InChIKey
DFVOJYCFQPZRSP-KHPPLWFESA-NSynonyms
(8Z)4(thiophen2yl)8(thiophen2ylmethylidene)345678hexahydroquinazoline2(1H)thione
(8Z)4thiophen2yl8(thiophen2ylmethylidene)134567hexahydroquinazoline2thione
C1CC(=CC2=CC=CS2)C3=C(C1)C(NC(=S)N3)C4=CC=CS4
InChI=1SC17H16N2S3c2017181511(10125282112)41613(15)16(1917)147392214h23571016H146H2(H2181920)b1110
MFCD03820238
S=C1NC2=C(C(N1)c1cccs1)CCCC2=Cc1cccs1
ZINC000053598544
ZINC000053598546
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