[4-(2,5-dimethylphenyl)sulfonylpiperazin-1-yl]-(3-pyrrol-1-ylthiophen-2-yl)methanone

Systemtic Name: [4-(2,5-dimethylphenyl)sulfonylpiperazin-1-yl]-(3-pyrrol-1-ylthiophen-2-yl)methanone Openeye Name: [4-(2,5-dimethylphenyl)sulfonylpiperazin-1-yl]-(3-pyrrol-1-yl-2-thienyl)methanone CAS Name: [4-(2,5-dimethylphenyl)sulfonyl-1-piperazinyl]-[3-(1-pyrrolyl)-2-thiophenyl]methanone IUPAC Name: [4-(2,5-dimethylphenyl)sulfonylpiperazin-1-yl]-(3-pyrrol-1-ylthiophen-2-yl)methanone Traditional Name: [4-(2,5-dimethylphenyl)sulfonylpiperazino]-(3-pyrrol-1-yl-2-thienyl)methanone Formula: C21H23N3O3S2 MolecularWeight: 429.55562

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C)S(=O)(=O)N2CCN(CC2)C(=O)C3=C(C=CS3)N4C=CC=C4

Isomeric SMILES

CC1=CC(=C(C=C1)C)S(=O)(=O)N2CCN(CC2)C(=O)C3=C(C=CS3)N4C=CC=C4

InChI

InChI=1S/C21H23N3O3S2/c1-16-5-6-17(2)19(15-16)29(26,27)24-12-10-23(11-13-24)21(25)20-18(7-14-28-20)22-8-3-4-9-22/h3-9,14-15H,10-13H2,1-2H3