methyl 2-[[3-[2-(dipropylamino)ethyl]-1H-indol-2-yl]-phenyl-methyl]sulfanylethanoate

Systemtic Name: methyl 2-[[3-[2-(dipropylamino)ethyl]-1H-indol-2-yl]-phenyl-methyl]sulfanylethanoate Openeye Name: methyl 2-[[3-[2-(dipropylamino)ethyl]-1H-indol-2-yl]-phenyl-methyl]sulfanylacetate CAS Name: 2-[[[3-[2-(dipropylamino)ethyl]-1H-indol-2-yl]-phenylmethyl]thio]acetic acid methyl ester IUPAC Name: methyl 2-[[3-[2-(dipropylamino)ethyl]-1H-indol-2-yl]-phenylmethyl]sulfanylacetate Traditional Name: 2-[[[3-[2-(dipropylamino)ethyl]-1H-indol-2-yl]-phenyl-methyl]thio]acetic acid methyl ester Formula: C26H34N2O2S MolecularWeight: 438.62536

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Descriptors Computed from Structure

Canonical SMILES:

CCCN(CCC)CCC1=C(NC2=CC=CC=C21)C(C3=CC=CC=C3)SCC(=O)OC

Isomeric SMILES

CCCN(CCC)CCC1=C(NC2=CC=CC=C21)C(C3=CC=CC=C3)SCC(=O)OC

InChI

InChI=1S/C26H34N2O2S/c1-4-16-28(17-5-2)18-15-22-21-13-9-10-14-23(21)27-25(22)26(31-19-24(29)30-3)20-11-7-6-8-12-20/h6-14,26-27H,4-5,15-19H2,1-3H3