6-[[(10-chloranylanthracen-9-yl)methylamino]methyl]-3-phenylsulfanyl-1H-indole-2-carboxamide

Systemtic Name: 6-[[(10-chloranylanthracen-9-yl)methylamino]methyl]-3-phenylsulfanyl-1H-indole-2-carboxamide Openeye Name: 6-[[(10-chloro-9-anthryl)methylamino]methyl]-3-phenylsulfanyl-1H-indole-2-carboxamide CAS Name: 6-[[(10-chloro-9-anthracenyl)methylamino]methyl]-3-(phenylthio)-1H-indole-2-carboxamide IUPAC Name: 6-[[(10-chloroanthracen-9-yl)methylamino]methyl]-3-phenylsulfanyl-1H-indole-2-carboxamide Traditional Name: 6-[[(10-chloro-9-anthryl)methylamino]methyl]-3-(phenylthio)-1H-indole-2-carboxamide Formula: C31H24ClN3OS MolecularWeight: 522.05976

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)SC2=C(NC3=C2C=CC(=C3)CNCC4=C5C=CC=CC5=C(C6=CC=CC=C64)Cl)C(=O)N

Isomeric SMILES

C1=CC=C(C=C1)SC2=C(NC3=C2C=CC(=C3)CNCC4=C5C=CC=CC5=C(C6=CC=CC=C64)Cl)C(=O)N

InChI

InChI=1S/C31H24ClN3OS/c32-28-23-12-6-4-10-21(23)26(22-11-5-7-13-24(22)28)18-34-17-19-14-15-25-27(16-19)35-29(31(33)36)30(25)37-20-8-2-1-3-9-20/h1-16,34-35H,17-18H2,(H2,33,36)