(2,5-dimethyl-1-propan-2-yl-pyrrol-3-yl)-(4-thiophen-2-ylsulfonylpiperazin-1-yl)methanone

Systemtic Name: (2,5-dimethyl-1-propan-2-yl-pyrrol-3-yl)-(4-thiophen-2-ylsulfonylpiperazin-1-yl)methanone Openeye Name: (1-isopropyl-2,5-dimethyl-pyrrol-3-yl)-[4-(2-thienylsulfonyl)piperazin-1-yl]methanone CAS Name: (2,5-dimethyl-1-propan-2-yl-3-pyrrolyl)-(4-thiophen-2-ylsulfonyl-1-piperazinyl)methanone IUPAC Name: (2,5-dimethyl-1-propan-2-ylpyrrol-3-yl)-(4-thiophen-2-ylsulfonylpiperazin-1-yl)methanone Traditional Name: (1-isopropyl-2,5-dimethyl-pyrrol-3-yl)-[4-(2-thienylsulfonyl)piperazino]methanone Formula: C18H25N3O3S2 MolecularWeight: 395.5394

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=CS3

Isomeric SMILES

CC1=CC(=C(N1C(C)C)C)C(=O)N2CCN(CC2)S(=O)(=O)C3=CC=CS3

InChI

InChI=1S/C18H25N3O3S2/c1-13(2)21-14(3)12-16(15(21)4)18(22)19-7-9-20(10-8-19)26(23,24)17-6-5-11-25-17/h5-6,11-13H,7-10H2,1-4H3