N-[(5-bromanyl-2-methoxy-phenyl)methyl]-6-methoxy-3-phenylsulfanyl-1H-indole-2-carboxamide

Systemtic Name: N-[(5-bromanyl-2-methoxy-phenyl)methyl]-6-methoxy-3-phenylsulfanyl-1H-indole-2-carboxamide Openeye Name: N-[(5-bromo-2-methoxy-phenyl)methyl]-6-methoxy-3-phenylsulfanyl-1H-indole-2-carboxamide CAS Name: N-[(5-bromo-2-methoxyphenyl)methyl]-6-methoxy-3-(phenylthio)-1H-indole-2-carboxamide IUPAC Name: N-[(5-bromo-2-methoxyphenyl)methyl]-6-methoxy-3-phenylsulfanyl-1H-indole-2-carboxamide Traditional Name: N-(5-bromo-2-methoxy-benzyl)-6-methoxy-3-(phenylthio)-1H-indole-2-carboxamide Formula: C24H21BrN2O3S MolecularWeight: 497.40414

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC2=C(C=C1)C(=C(N2)C(=O)NCC3=C(C=CC(=C3)Br)OC)SC4=CC=CC=C4

Isomeric SMILES

COC1=CC2=C(C=C1)C(=C(N2)C(=O)NCC3=C(C=CC(=C3)Br)OC)SC4=CC=CC=C4

InChI

InChI=1S/C24H21BrN2O3S/c1-29-17-9-10-19-20(13-17)27-22(23(19)31-18-6-4-3-5-7-18)24(28)26-14-15-12-16(25)8-11-21(15)30-2/h3-13,27H,14H2,1-2H3,(H,26,28)