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

Systemtic Name: [4-(5-bromanylthiophen-2-yl)sulfonylpiperazin-1-yl]-(1-cyclopropyl-2,5-dimethyl-pyrrol-3-yl)methanone Openeye Name: [4-[(5-bromo-2-thienyl)sulfonyl]piperazin-1-yl]-(1-cyclopropyl-2,5-dimethyl-pyrrol-3-yl)methanone CAS Name: [4-[(5-bromo-2-thiophenyl)sulfonyl]-1-piperazinyl]-(1-cyclopropyl-2,5-dimethyl-3-pyrrolyl)methanone IUPAC Name: [4-(5-bromothiophen-2-yl)sulfonylpiperazin-1-yl]-(1-cyclopropyl-2,5-dimethylpyrrol-3-yl)methanone Traditional Name: [4-[(5-bromo-2-thienyl)sulfonyl]piperazino]-(1-cyclopropyl-2,5-dimethyl-pyrrol-3-yl)methanone Formula: C18H22BrN3O3S2 MolecularWeight: 472.41958

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(N1C2CC2)C)C(=O)N3CCN(CC3)S(=O)(=O)C4=CC=C(S4)Br

Isomeric SMILES

CC1=CC(=C(N1C2CC2)C)C(=O)N3CCN(CC3)S(=O)(=O)C4=CC=C(S4)Br

InChI

InChI=1S/C18H22BrN3O3S2/c1-12-11-15(13(2)22(12)14-3-4-14)18(23)20-7-9-21(10-8-20)27(24,25)17-6-5-16(19)26-17/h5-6,11,14H,3-4,7-10H2,1-2H3