6-[[[4-[(E)-2-phenylethenyl]phenyl]methylamino]methyl]-3-phenylsulfanyl-1H-indole-2-carboxamide

Systemtic Name: 6-[[[4-[(E)-2-phenylethenyl]phenyl]methylamino]methyl]-3-phenylsulfanyl-1H-indole-2-carboxamide Openeye Name: 3-phenylsulfanyl-6-[[[4-[(E)-styryl]phenyl]methylamino]methyl]-1H-indole-2-carboxamide CAS Name: 6-[[[4-[(E)-2-phenylethenyl]phenyl]methylamino]methyl]-3-(phenylthio)-1H-indole-2-carboxamide IUPAC Name: 6-[[[4-[(E)-2-phenylethenyl]phenyl]methylamino]methyl]-3-phenylsulfanyl-1H-indole-2-carboxamide Traditional Name: 3-(phenylthio)-6-[[[4-[(E)-styryl]benzyl]amino]methyl]-1H-indole-2-carboxamide Formula: C31H27N3OS MolecularWeight: 489.63058

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C=CC2=CC=C(C=C2)CNCC3=CC4=C(C=C3)C(=C(N4)C(=O)N)SC5=CC=CC=C5

Isomeric SMILES

C1=CC=C(C=C1)/C=C/C2=CC=C(C=C2)CNCC3=CC4=C(C=C3)C(=C(N4)C(=O)N)SC5=CC=CC=C5

InChI

InChI=1S/C31H27N3OS/c32-31(35)29-30(36-26-9-5-2-6-10-26)27-18-17-25(19-28(27)34-29)21-33-20-24-15-13-23(14-16-24)12-11-22-7-3-1-4-8-22/h1-19,33-34H,20-21H2,(H2,32,35)/b12-11+