2-[[(5Z)-4-(4-chlorophenyl)-5-indol-3-ylidene-1H-1,2,4-triazol-3-yl]sulfanylmethyl]-1H-quinazolin-4-one

Systemtic Name: 2-[[(5Z)-4-(4-chlorophenyl)-5-indol-3-ylidene-1H-1,2,4-triazol-3-yl]sulfanylmethyl]-1H-quinazolin-4-one Openeye Name: 2-[[(5Z)-4-(4-chlorophenyl)-5-indol-3-ylidene-1H-1,2,4-triazol-3-yl]sulfanylmethyl]-1H-quinazolin-4-one CAS Name: 2-[[[(5Z)-4-(4-chlorophenyl)-5-(3-indolylidene)-1H-1,2,4-triazol-3-yl]thio]methyl]-1H-quinazolin-4-one IUPAC Name: 2-[[(5Z)-4-(4-chlorophenyl)-5-indol-3-ylidene-1H-1,2,4-triazol-3-yl]sulfanylmethyl]-1H-quinazolin-4-one Traditional Name: 2-[[[(5Z)-4-(4-chlorophenyl)-5-indol-3-ylidene-1H-1,2,4-triazol-3-yl]thio]methyl]-1H-quinazolin-4-one Formula: C25H17ClN6OS MolecularWeight: 484.96008

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=O)N=C(N2)CSC3=NNC(=C4C=NC5=CC=CC=C54)N3C6=CC=C(C=C6)Cl

Isomeric SMILES

C1=CC=C2C(=C1)C(=O)N=C(N2)CSC3=NN/C(=C/4\C=NC5=CC=CC=C54)/N3C6=CC=C(C=C6)Cl

InChI

InChI=1S/C25H17ClN6OS/c26-15-9-11-16(12-10-15)32-23(19-13-27-20-7-3-1-5-17(19)20)30-31-25(32)34-14-22-28-21-8-4-2-6-18(21)24(33)29-22/h1-13,30H,14H2,(H,28,29,33)/b23-19-