(E)-3-(1-butyl-2,5-dimethyl-pyrrol-3-yl)-2-cyano-N-[(4S)-3,4-dihydro-2H-chromen-4-yl]prop-2-enamide

Systemtic Name: (E)-3-(1-butyl-2,5-dimethyl-pyrrol-3-yl)-2-cyano-N-[(4S)-3,4-dihydro-2H-chromen-4-yl]prop-2-enamide Openeye Name: (E)-3-(1-butyl-2,5-dimethyl-pyrrol-3-yl)-N-[(4S)-chroman-4-yl]-2-cyano-prop-2-enamide CAS Name: (E)-3-(1-butyl-2,5-dimethyl-3-pyrrolyl)-2-cyano-N-[(4S)-3,4-dihydro-2H-1-benzopyran-4-yl]-2-propenamide IUPAC Name: (E)-3-(1-butyl-2,5-dimethylpyrrol-3-yl)-2-cyano-N-[(4S)-3,4-dihydro-2H-chromen-4-yl]prop-2-enamide Traditional Name: (E)-3-(1-butyl-2,5-dimethyl-pyrrol-3-yl)-N-[(4S)-chroman-4-yl]-2-cyano-acrylamide Formula: C23H27N3O2 MolecularWeight: 377.47938

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C(=CC(=C1C)C=C(C#N)C(=O)NC2CCOC3=CC=CC=C23)C

Isomeric SMILES

CCCCN1C(=CC(=C1C)/C=C(\C#N)/C(=O)N[C@H]2CCOC3=CC=CC=C23)C

InChI

InChI=1S/C23H27N3O2/c1-4-5-11-26-16(2)13-18(17(26)3)14-19(15-24)23(27)25-21-10-12-28-22-9-7-6-8-20(21)22/h6-9,13-14,21H,4-5,10-12H2,1-3H3,(H,25,27)/b19-14+/t21-/m0/s1