3-[3-[2-[(5-cyclopropyl-1-phenyl-1,2,4-triazol-3-yl)sulfanyl]ethanoyl]indol-1-yl]propanenitrile

Systemtic Name: 3-[3-[2-[(5-cyclopropyl-1-phenyl-1,2,4-triazol-3-yl)sulfanyl]ethanoyl]indol-1-yl]propanenitrile Openeye Name: 3-[3-[2-[(5-cyclopropyl-1-phenyl-1,2,4-triazol-3-yl)sulfanyl]acetyl]indol-1-yl]propanenitrile CAS Name: 3-[3-[2-[(5-cyclopropyl-1-phenyl-1,2,4-triazol-3-yl)thio]-1-oxoethyl]-1-indolyl]propanenitrile IUPAC Name: 3-[3-[2-[(5-cyclopropyl-1-phenyl-1,2,4-triazol-3-yl)sulfanyl]acetyl]indol-1-yl]propanenitrile Traditional Name: 3-[3-[2-[(5-cyclopropyl-1-phenyl-1,2,4-triazol-3-yl)thio]acetyl]indol-1-yl]propionitrile Formula: C24H21N5OS MolecularWeight: 427.52144

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Descriptors Computed from Structure

Canonical SMILES:

C1CC1C2=NC(=NN2C3=CC=CC=C3)SCC(=O)C4=CN(C5=CC=CC=C54)CCC#N

Isomeric SMILES

C1CC1C2=NC(=NN2C3=CC=CC=C3)SCC(=O)C4=CN(C5=CC=CC=C54)CCC#N

InChI

InChI=1S/C24H21N5OS/c25-13-6-14-28-15-20(19-9-4-5-10-21(19)28)22(30)16-31-24-26-23(17-11-12-17)29(27-24)18-7-2-1-3-8-18/h1-5,7-10,15,17H,6,11-12,14,16H2