N-[2-[3-[(3,4-dichlorophenyl)methylsulfanyl]indol-1-yl]ethyl]-4-ethoxy-benzamide

Systemtic Name: N-[2-[3-[(3,4-dichlorophenyl)methylsulfanyl]indol-1-yl]ethyl]-4-ethoxy-benzamide Openeye Name: N-[2-[3-[(3,4-dichlorophenyl)methylsulfanyl]indol-1-yl]ethyl]-4-ethoxy-benzamide CAS Name: N-[2-[3-[(3,4-dichlorophenyl)methylthio]-1-indolyl]ethyl]-4-ethoxybenzamide IUPAC Name: N-[2-[3-[(3,4-dichlorophenyl)methylsulfanyl]indol-1-yl]ethyl]-4-ethoxybenzamide Traditional Name: N-[2-[3-[(3,4-dichlorobenzyl)thio]indol-1-yl]ethyl]-4-ethoxy-benzamide Formula: C26H24Cl2N2O2S MolecularWeight: 499.45196

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)C(=O)NCCN2C=C(C3=CC=CC=C32)SCC4=CC(=C(C=C4)Cl)Cl

Isomeric SMILES

CCOC1=CC=C(C=C1)C(=O)NCCN2C=C(C3=CC=CC=C32)SCC4=CC(=C(C=C4)Cl)Cl

InChI

InChI=1S/C26H24Cl2N2O2S/c1-2-32-20-10-8-19(9-11-20)26(31)29-13-14-30-16-25(21-5-3-4-6-24(21)30)33-17-18-7-12-22(27)23(28)15-18/h3-12,15-16H,2,13-14,17H2,1H3,(H,29,31)