2-phenylpropyl (E)-2-(1-methylindol-2-yl)sulfanylbut-2-enoate

Systemtic Name: 2-phenylpropyl (E)-2-(1-methylindol-2-yl)sulfanylbut-2-enoate Openeye Name: 2-phenylpropyl (E)-2-(1-methylindol-2-yl)sulfanylbut-2-enoate CAS Name: (E)-2-[(1-methyl-2-indolyl)thio]-2-butenoic acid 2-phenylpropyl ester IUPAC Name: 2-phenylpropyl (E)-2-(1-methylindol-2-yl)sulfanylbut-2-enoate Traditional Name: (E)-2-[(1-methylindol-2-yl)thio]but-2-enoic acid 2-phenylpropyl ester Formula: C22H23NO2S MolecularWeight: 365.48852

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Descriptors Computed from Structure

Canonical SMILES:

CC=C(C(=O)OCC(C)C1=CC=CC=C1)SC2=CC3=CC=CC=C3N2C

Isomeric SMILES

C/C=C(\C(=O)OCC(C)C1=CC=CC=C1)/SC2=CC3=CC=CC=C3N2C

InChI

InChI=1S/C22H23NO2S/c1-4-20(22(24)25-15-16(2)17-10-6-5-7-11-17)26-21-14-18-12-8-9-13-19(18)23(21)3/h4-14,16H,15H2,1-3H3/b20-4+