2-[4-(5-chloranylthiophen-2-yl)sulfonylpiperazin-1-yl]-N-[(2,4-dimethylphenyl)carbamoyl]propanamide

Systemtic Name: 2-[4-(5-chloranylthiophen-2-yl)sulfonylpiperazin-1-yl]-N-[(2,4-dimethylphenyl)carbamoyl]propanamide Openeye Name: 2-[4-[(5-chloro-2-thienyl)sulfonyl]piperazin-1-yl]-N-[(2,4-dimethylphenyl)carbamoyl]propanamide CAS Name: 2-[4-[(5-chloro-2-thiophenyl)sulfonyl]-1-piperazinyl]-N-[(2,4-dimethylanilino)-oxomethyl]propanamide IUPAC Name: 2-[4-(5-chlorothiophen-2-yl)sulfonylpiperazin-1-yl]-N-[(2,4-dimethylphenyl)carbamoyl]propanamide Traditional Name: 2-[4-[(5-chloro-2-thienyl)sulfonyl]piperazino]-N-[(2,4-dimethylphenyl)carbamoyl]propionamide Formula: C20H25ClN4O4S2 MolecularWeight: 485.0199

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)NC(=O)NC(=O)C(C)N2CCN(CC2)S(=O)(=O)C3=CC=C(S3)Cl)C

Isomeric SMILES

CC1=CC(=C(C=C1)NC(=O)NC(=O)C(C)N2CCN(CC2)S(=O)(=O)C3=CC=C(S3)Cl)C

InChI

InChI=1S/C20H25ClN4O4S2/c1-13-4-5-16(14(2)12-13)22-20(27)23-19(26)15(3)24-8-10-25(11-9-24)31(28,29)18-7-6-17(21)30-18/h4-7,12,15H,8-11H2,1-3H3,(H2,22,23,26,27)