2-[[2-[2-(1H-indol-3-yl)ethyl]-[1,2,4]triazolo[1,5-c]quinazolin-5-yl]sulfanyl]-N-[(4-methylphenyl)methyl]ethanamide

Systemtic Name: 2-[[2-[2-(1H-indol-3-yl)ethyl]-[1,2,4]triazolo[1,5-c]quinazolin-5-yl]sulfanyl]-N-[(4-methylphenyl)methyl]ethanamide Openeye Name: 2-[[2-[2-(1H-indol-3-yl)ethyl]-[1,2,4]triazolo[1,5-c]quinazolin-5-yl]sulfanyl]-N-(p-tolylmethyl)acetamide CAS Name: 2-[[2-[2-(1H-indol-3-yl)ethyl]-[1,2,4]triazolo[1,5-c]quinazolin-5-yl]thio]-N-[(4-methylphenyl)methyl]acetamide IUPAC Name: 2-[[2-[2-(1H-indol-3-yl)ethyl]-[1,2,4]triazolo[1,5-c]quinazolin-5-yl]sulfanyl]-N-[(4-methylphenyl)methyl]acetamide Traditional Name: 2-[[2-[2-(1H-indol-3-yl)ethyl]-[1,2,4]triazolo[1,5-c]quinazolin-5-yl]thio]-N-(4-methylbenzyl)acetamide Formula: C29H26N6OS MolecularWeight: 506.62134

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)CNC(=O)CSC2=NC3=CC=CC=C3C4=NC(=NN42)CCC5=CNC6=CC=CC=C65

Isomeric SMILES

CC1=CC=C(C=C1)CNC(=O)CSC2=NC3=CC=CC=C3C4=NC(=NN42)CCC5=CNC6=CC=CC=C65

InChI

InChI=1S/C29H26N6OS/c1-19-10-12-20(13-11-19)16-31-27(36)18-37-29-32-25-9-5-3-7-23(25)28-33-26(34-35(28)29)15-14-21-17-30-24-8-4-2-6-22(21)24/h2-13,17,30H,14-16,18H2,1H3,(H,31,36)