2-[4-(5-bromanylthiophen-2-yl)sulfonylpiperazin-1-yl]-N-(3-cyano-4-ethyl-5-methyl-thiophen-2-yl)ethanamide

Systemtic Name: 2-[4-(5-bromanylthiophen-2-yl)sulfonylpiperazin-1-yl]-N-(3-cyano-4-ethyl-5-methyl-thiophen-2-yl)ethanamide Openeye Name: 2-[4-[(5-bromo-2-thienyl)sulfonyl]piperazin-1-yl]-N-(3-cyano-4-ethyl-5-methyl-2-thienyl)acetamide CAS Name: 2-[4-[(5-bromo-2-thiophenyl)sulfonyl]-1-piperazinyl]-N-(3-cyano-4-ethyl-5-methyl-2-thiophenyl)acetamide IUPAC Name: 2-[4-(5-bromothiophen-2-yl)sulfonylpiperazin-1-yl]-N-(3-cyano-4-ethyl-5-methylthiophen-2-yl)acetamide Traditional Name: 2-[4-[(5-bromo-2-thienyl)sulfonyl]piperazino]-N-(3-cyano-4-ethyl-5-methyl-2-thienyl)acetamide Formula: C18H21BrN4O3S3 MolecularWeight: 517.48334

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(SC(=C1C#N)NC(=O)CN2CCN(CC2)S(=O)(=O)C3=CC=C(S3)Br)C

Isomeric SMILES

CCC1=C(SC(=C1C#N)NC(=O)CN2CCN(CC2)S(=O)(=O)C3=CC=C(S3)Br)C

InChI

InChI=1S/C18H21BrN4O3S3/c1-3-13-12(2)27-18(14(13)10-20)21-16(24)11-22-6-8-23(9-7-22)29(25,26)17-5-4-15(19)28-17/h4-5H,3,6-9,11H2,1-2H3,(H,21,24)