(E)-3-(1-cyclopropyl-2,5-dimethyl-pyrrol-3-yl)-1-[4-(4-fluorophenyl)piperazin-1-yl]prop-2-en-1-one

Systemtic Name: (E)-3-(1-cyclopropyl-2,5-dimethyl-pyrrol-3-yl)-1-[4-(4-fluorophenyl)piperazin-1-yl]prop-2-en-1-one Openeye Name: (E)-3-(1-cyclopropyl-2,5-dimethyl-pyrrol-3-yl)-1-[4-(4-fluorophenyl)piperazin-1-yl]prop-2-en-1-one CAS Name: (E)-3-(1-cyclopropyl-2,5-dimethyl-3-pyrrolyl)-1-[4-(4-fluorophenyl)-1-piperazinyl]-2-propen-1-one IUPAC Name: (E)-3-(1-cyclopropyl-2,5-dimethylpyrrol-3-yl)-1-[4-(4-fluorophenyl)piperazin-1-yl]prop-2-en-1-one Traditional Name: (E)-3-(1-cyclopropyl-2,5-dimethyl-pyrrol-3-yl)-1-[4-(4-fluorophenyl)piperazino]prop-2-en-1-one Formula: C22H26FN3O MolecularWeight: 367.459743

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(N1C2CC2)C)C=CC(=O)N3CCN(CC3)C4=CC=C(C=C4)F

Isomeric SMILES

CC1=CC(=C(N1C2CC2)C)/C=C/C(=O)N3CCN(CC3)C4=CC=C(C=C4)F

InChI

InChI=1S/C22H26FN3O/c1-16-15-18(17(2)26(16)21-8-9-21)3-10-22(27)25-13-11-24(12-14-25)20-6-4-19(23)5-7-20/h3-7,10,15,21H,8-9,11-14H2,1-2H3/b10-3+