3-(4-chlorophenyl)sulfanyl-N-[3-[ethyl-(3-methylphenyl)amino]propyl]-1H-indole-2-carboxamide

Systemtic Name: 3-(4-chlorophenyl)sulfanyl-N-[3-[ethyl-(3-methylphenyl)amino]propyl]-1H-indole-2-carboxamide Openeye Name: 3-(4-chlorophenyl)sulfanyl-N-[3-(N-ethyl-3-methyl-anilino)propyl]-1H-indole-2-carboxamide CAS Name: 3-[(4-chlorophenyl)thio]-N-[3-(N-ethyl-3-methylanilino)propyl]-1H-indole-2-carboxamide IUPAC Name: 3-(4-chlorophenyl)sulfanyl-N-[3-(N-ethyl-3-methylanilino)propyl]-1H-indole-2-carboxamide Traditional Name: 3-[(4-chlorophenyl)thio]-N-[3-(N-ethyl-3-methyl-anilino)propyl]-1H-indole-2-carboxamide Formula: C27H28ClN3OS MolecularWeight: 478.04872

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CCCNC(=O)C1=C(C2=CC=CC=C2N1)SC3=CC=C(C=C3)Cl)C4=CC=CC(=C4)C

Isomeric SMILES

CCN(CCCNC(=O)C1=C(C2=CC=CC=C2N1)SC3=CC=C(C=C3)Cl)C4=CC=CC(=C4)C

InChI

InChI=1S/C27H28ClN3OS/c1-3-31(21-9-6-8-19(2)18-21)17-7-16-29-27(32)25-26(23-10-4-5-11-24(23)30-25)33-22-14-12-20(28)13-15-22/h4-6,8-15,18,30H,3,7,16-17H2,1-2H3,(H,29,32)