methyl 3-[1-[(4-chlorophenyl)methyl]-4,6-dimethyl-3-phenylsulfanyl-5-propan-2-yl-indol-2-yl]propanoate

Systemtic Name: methyl 3-[1-[(4-chlorophenyl)methyl]-4,6-dimethyl-3-phenylsulfanyl-5-propan-2-yl-indol-2-yl]propanoate Openeye Name: methyl 3-[1-[(4-chlorophenyl)methyl]-5-isopropyl-4,6-dimethyl-3-phenylsulfanyl-indol-2-yl]propanoate CAS Name: 3-[1-[(4-chlorophenyl)methyl]-4,6-dimethyl-3-(phenylthio)-5-propan-2-yl-2-indolyl]propanoic acid methyl ester IUPAC Name: methyl 3-[1-[(4-chlorophenyl)methyl]-4,6-dimethyl-3-phenylsulfanyl-5-propan-2-ylindol-2-yl]propanoate Traditional Name: 3-[1-(4-chlorobenzyl)-5-isopropyl-4,6-dimethyl-3-(phenylthio)indol-2-yl]propionic acid methyl ester Formula: C30H32ClNO2S MolecularWeight: 506.09858

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C(=C1C(C)C)C)C(=C(N2CC3=CC=C(C=C3)Cl)CCC(=O)OC)SC4=CC=CC=C4

Isomeric SMILES

CC1=CC2=C(C(=C1C(C)C)C)C(=C(N2CC3=CC=C(C=C3)Cl)CCC(=O)OC)SC4=CC=CC=C4

InChI

InChI=1S/C30H32ClNO2S/c1-19(2)28-20(3)17-26-29(21(28)4)30(35-24-9-7-6-8-10-24)25(15-16-27(33)34-5)32(26)18-22-11-13-23(31)14-12-22/h6-14,17,19H,15-16,18H2,1-5H3