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

Systemtic Name: (E)-3-(1-cyclopropyl-2,5-dimethyl-pyrrol-3-yl)-1-[4-(4-ethanoylphenyl)sulfonylpiperazin-1-yl]prop-2-en-1-one Openeye Name: (E)-1-[4-(4-acetylphenyl)sulfonylpiperazin-1-yl]-3-(1-cyclopropyl-2,5-dimethyl-pyrrol-3-yl)prop-2-en-1-one CAS Name: (E)-1-[4-(4-acetylphenyl)sulfonyl-1-piperazinyl]-3-(1-cyclopropyl-2,5-dimethyl-3-pyrrolyl)-2-propen-1-one IUPAC Name: (E)-1-[4-(4-acetylphenyl)sulfonylpiperazin-1-yl]-3-(1-cyclopropyl-2,5-dimethylpyrrol-3-yl)prop-2-en-1-one Traditional Name: (E)-1-[4-(4-acetylphenyl)sulfonylpiperazino]-3-(1-cyclopropyl-2,5-dimethyl-pyrrol-3-yl)prop-2-en-1-one Formula: C24H29N3O4S MolecularWeight: 455.56976

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C24H29N3O4S/c1-17-16-21(18(2)27(17)22-7-8-22)6-11-24(29)25-12-14-26(15-13-25)32(30,31)23-9-4-20(5-10-23)19(3)28/h4-6,9-11,16,22H,7-8,12-15H2,1-3H3/b11-6+