2-[2-[[5-oxidanylidene-4-(phenylmethyl)-[1,2,4]triazolo[4,3-a]quinazolin-1-yl]sulfanyl]ethanoylamino]thiophene-3-carboxamide

Systemtic Name: 2-[2-[[5-oxidanylidene-4-(phenylmethyl)-[1,2,4]triazolo[4,3-a]quinazolin-1-yl]sulfanyl]ethanoylamino]thiophene-3-carboxamide Openeye Name: 2-[[2-[(4-benzyl-5-oxo-[1,2,4]triazolo[4,3-a]quinazolin-1-yl)sulfanyl]acetyl]amino]thiophene-3-carboxamide CAS Name: 2-[[1-oxo-2-[[5-oxo-4-(phenylmethyl)-[1,2,4]triazolo[4,3-a]quinazolin-1-yl]thio]ethyl]amino]-3-thiophenecarboxamide IUPAC Name: 2-[[2-[(4-benzyl-5-oxo-[1,2,4]triazolo[4,3-a]quinazolin-1-yl)sulfanyl]acetyl]amino]thiophene-3-carboxamide Traditional Name: 2-[[2-[(4-benzyl-5-keto-[1,2,4]triazolo[4,3-a]quinazolin-1-yl)thio]acetyl]amino]thiophene-3-carboxamide Formula: C23H18N6O3S2 MolecularWeight: 490.55742

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CN2C(=O)C3=CC=CC=C3N4C2=NN=C4SCC(=O)NC5=C(C=CS5)C(=O)N

Isomeric SMILES

C1=CC=C(C=C1)CN2C(=O)C3=CC=CC=C3N4C2=NN=C4SCC(=O)NC5=C(C=CS5)C(=O)N

InChI

InChI=1S/C23H18N6O3S2/c24-19(31)16-10-11-33-20(16)25-18(30)13-34-23-27-26-22-28(12-14-6-2-1-3-7-14)21(32)15-8-4-5-9-17(15)29(22)23/h1-11H,12-13H2,(H2,24,31)(H,25,30)