2-[4-(5-bromanylthiophen-2-yl)sulfonylpiperazin-1-yl]-N-(3,4-dimethylphenyl)ethanamide

Systemtic Name: 2-[4-(5-bromanylthiophen-2-yl)sulfonylpiperazin-1-yl]-N-(3,4-dimethylphenyl)ethanamide Openeye Name: 2-[4-[(5-bromo-2-thienyl)sulfonyl]piperazin-1-yl]-N-(3,4-dimethylphenyl)acetamide CAS Name: 2-[4-[(5-bromo-2-thiophenyl)sulfonyl]-1-piperazinyl]-N-(3,4-dimethylphenyl)acetamide IUPAC Name: 2-[4-(5-bromothiophen-2-yl)sulfonylpiperazin-1-yl]-N-(3,4-dimethylphenyl)acetamide Traditional Name: 2-[4-[(5-bromo-2-thienyl)sulfonyl]piperazino]-N-(3,4-dimethylphenyl)acetamide Formula: C18H22BrN3O3S2 MolecularWeight: 472.41958

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)NC(=O)CN2CCN(CC2)S(=O)(=O)C3=CC=C(S3)Br)C

Isomeric SMILES

CC1=C(C=C(C=C1)NC(=O)CN2CCN(CC2)S(=O)(=O)C3=CC=C(S3)Br)C

InChI

InChI=1S/C18H22BrN3O3S2/c1-13-3-4-15(11-14(13)2)20-17(23)12-21-7-9-22(10-8-21)27(24,25)18-6-5-16(19)26-18/h3-6,11H,7-10,12H2,1-2H3,(H,20,23)