(E)-3-(1-cyclohexyl-2,5-dimethyl-pyrrol-3-yl)-1-(4-thiophen-2-ylcarbonylpiperazin-1-yl)prop-2-en-1-one

Systemtic Name: (E)-3-(1-cyclohexyl-2,5-dimethyl-pyrrol-3-yl)-1-(4-thiophen-2-ylcarbonylpiperazin-1-yl)prop-2-en-1-one Openeye Name: (E)-3-(1-cyclohexyl-2,5-dimethyl-pyrrol-3-yl)-1-[4-(thiophene-2-carbonyl)piperazin-1-yl]prop-2-en-1-one CAS Name: (E)-3-(1-cyclohexyl-2,5-dimethyl-3-pyrrolyl)-1-[4-[oxo(thiophen-2-yl)methyl]-1-piperazinyl]-2-propen-1-one IUPAC Name: (E)-3-(1-cyclohexyl-2,5-dimethylpyrrol-3-yl)-1-[4-(thiophene-2-carbonyl)piperazin-1-yl]prop-2-en-1-one Traditional Name: (E)-3-(1-cyclohexyl-2,5-dimethyl-pyrrol-3-yl)-1-[4-(2-thenoyl)piperazino]prop-2-en-1-one Formula: C24H31N3O2S MolecularWeight: 425.58684

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(N1C2CCCCC2)C)C=CC(=O)N3CCN(CC3)C(=O)C4=CC=CS4

Isomeric SMILES

CC1=CC(=C(N1C2CCCCC2)C)/C=C/C(=O)N3CCN(CC3)C(=O)C4=CC=CS4

InChI

InChI=1S/C24H31N3O2S/c1-18-17-20(19(2)27(18)21-7-4-3-5-8-21)10-11-23(28)25-12-14-26(15-13-25)24(29)22-9-6-16-30-22/h6,9-11,16-17,21H,3-5,7-8,12-15H2,1-2H3/b11-10+