(E)-3-(1-cyclopropyl-2,5-dimethyl-pyrrol-3-yl)-N-(2-phenylsulfanylethyl)prop-2-enamide

Systemtic Name: (E)-3-(1-cyclopropyl-2,5-dimethyl-pyrrol-3-yl)-N-(2-phenylsulfanylethyl)prop-2-enamide Openeye Name: (E)-3-(1-cyclopropyl-2,5-dimethyl-pyrrol-3-yl)-N-(2-phenylsulfanylethyl)prop-2-enamide CAS Name: (E)-3-(1-cyclopropyl-2,5-dimethyl-3-pyrrolyl)-N-[2-(phenylthio)ethyl]-2-propenamide IUPAC Name: (E)-3-(1-cyclopropyl-2,5-dimethylpyrrol-3-yl)-N-(2-phenylsulfanylethyl)prop-2-enamide Traditional Name: (E)-3-(1-cyclopropyl-2,5-dimethyl-pyrrol-3-yl)-N-[2-(phenylthio)ethyl]acrylamide Formula: C20H24N2OS MolecularWeight: 340.48236

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(N1C2CC2)C)C=CC(=O)NCCSC3=CC=CC=C3

Isomeric SMILES

CC1=CC(=C(N1C2CC2)C)/C=C/C(=O)NCCSC3=CC=CC=C3

InChI

InChI=1S/C20H24N2OS/c1-15-14-17(16(2)22(15)18-9-10-18)8-11-20(23)21-12-13-24-19-6-4-3-5-7-19/h3-8,11,14,18H,9-10,12-13H2,1-2H3,(H,21,23)/b11-8+