2-phenylpentyl (Z)-2-(1-methylindol-2-yl)sulfanylbut-2-enoate

Systemtic Name: 2-phenylpentyl (Z)-2-(1-methylindol-2-yl)sulfanylbut-2-enoate Openeye Name: 2-phenylpentyl (Z)-2-(1-methylindol-2-yl)sulfanylbut-2-enoate CAS Name: (Z)-2-[(1-methyl-2-indolyl)thio]-2-butenoic acid 2-phenylpentyl ester IUPAC Name: 2-phenylpentyl (Z)-2-(1-methylindol-2-yl)sulfanylbut-2-enoate Traditional Name: (Z)-2-[(1-methylindol-2-yl)thio]but-2-enoic acid 2-phenylpentyl ester Formula: C24H27NO2S MolecularWeight: 393.54168

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(COC(=O)C(=CC)SC1=CC2=CC=CC=C2N1C)C3=CC=CC=C3

Isomeric SMILES

CCCC(COC(=O)/C(=C/C)/SC1=CC2=CC=CC=C2N1C)C3=CC=CC=C3

InChI

InChI=1S/C24H27NO2S/c1-4-11-20(18-12-7-6-8-13-18)17-27-24(26)22(5-2)28-23-16-19-14-9-10-15-21(19)25(23)3/h5-10,12-16,20H,4,11,17H2,1-3H3/b22-5-