(2,5-dimethyl-1-propan-2-yl-pyrrol-3-yl)-[4-(4-fluorophenyl)sulfonylpiperazin-1-yl]methanone

Systemtic Name: (2,5-dimethyl-1-propan-2-yl-pyrrol-3-yl)-[4-(4-fluorophenyl)sulfonylpiperazin-1-yl]methanone Openeye Name: [4-(4-fluorophenyl)sulfonylpiperazin-1-yl]-(1-isopropyl-2,5-dimethyl-pyrrol-3-yl)methanone CAS Name: (2,5-dimethyl-1-propan-2-yl-3-pyrrolyl)-[4-(4-fluorophenyl)sulfonyl-1-piperazinyl]methanone IUPAC Name: (2,5-dimethyl-1-propan-2-ylpyrrol-3-yl)-[4-(4-fluorophenyl)sulfonylpiperazin-1-yl]methanone Traditional Name: [4-(4-fluorophenyl)sulfonylpiperazino]-(1-isopropyl-2,5-dimethyl-pyrrol-3-yl)methanone Formula: C20H26FN3O3S MolecularWeight: 407.502143

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(N1C(C)C)C)C(=O)N2CCN(CC2)S(=O)(=O)C3=CC=C(C=C3)F

Isomeric SMILES

CC1=CC(=C(N1C(C)C)C)C(=O)N2CCN(CC2)S(=O)(=O)C3=CC=C(C=C3)F

InChI

InChI=1S/C20H26FN3O3S/c1-14(2)24-15(3)13-19(16(24)4)20(25)22-9-11-23(12-10-22)28(26,27)18-7-5-17(21)6-8-18/h5-8,13-14H,9-12H2,1-4H3