N-(3-ethoxypropyl)-6-methoxy-3-(4-methylphenyl)sulfanyl-1H-indole-2-carboxamide

Systemtic Name: N-(3-ethoxypropyl)-6-methoxy-3-(4-methylphenyl)sulfanyl-1H-indole-2-carboxamide Openeye Name: N-(3-ethoxypropyl)-6-methoxy-3-(p-tolylsulfanyl)-1H-indole-2-carboxamide CAS Name: N-(3-ethoxypropyl)-6-methoxy-3-[(4-methylphenyl)thio]-1H-indole-2-carboxamide IUPAC Name: N-(3-ethoxypropyl)-6-methoxy-3-(4-methylphenyl)sulfanyl-1H-indole-2-carboxamide Traditional Name: N-(3-ethoxypropyl)-6-methoxy-3-(p-tolylthio)-1H-indole-2-carboxamide Formula: C22H26N2O3S MolecularWeight: 398.51844

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Descriptors Computed from Structure

Canonical SMILES:

CCOCCCNC(=O)C1=C(C2=C(N1)C=C(C=C2)OC)SC3=CC=C(C=C3)C

Isomeric SMILES

CCOCCCNC(=O)C1=C(C2=C(N1)C=C(C=C2)OC)SC3=CC=C(C=C3)C

InChI

InChI=1S/C22H26N2O3S/c1-4-27-13-5-12-23-22(25)20-21(28-17-9-6-15(2)7-10-17)18-11-8-16(26-3)14-19(18)24-20/h6-11,14,24H,4-5,12-13H2,1-3H3,(H,23,25)