2-[(5-chloranylthiophen-2-yl)sulfonyl-methyl-amino]-N-[4-(4,6-dimethylpyrimidin-2-yl)sulfanylphenyl]ethanamide

Systemtic Name: 2-[(5-chloranylthiophen-2-yl)sulfonyl-methyl-amino]-N-[4-(4,6-dimethylpyrimidin-2-yl)sulfanylphenyl]ethanamide Openeye Name: 2-[(5-chloro-2-thienyl)sulfonyl-methyl-amino]-N-[4-(4,6-dimethylpyrimidin-2-yl)sulfanylphenyl]acetamide CAS Name: 2-[(5-chloro-2-thiophenyl)sulfonyl-methylamino]-N-[4-[(4,6-dimethyl-2-pyrimidinyl)thio]phenyl]acetamide IUPAC Name: 2-[(5-chlorothiophen-2-yl)sulfonyl-methylamino]-N-[4-(4,6-dimethylpyrimidin-2-yl)sulfanylphenyl]acetamide Traditional Name: 2-[(5-chloro-2-thienyl)sulfonyl-methyl-amino]-N-[4-[(4,6-dimethylpyrimidin-2-yl)thio]phenyl]acetamide Formula: C19H19ClN4O3S3 MolecularWeight: 483.02716

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NC(=N1)SC2=CC=C(C=C2)NC(=O)CN(C)S(=O)(=O)C3=CC=C(S3)Cl)C

Isomeric SMILES

CC1=CC(=NC(=N1)SC2=CC=C(C=C2)NC(=O)CN(C)S(=O)(=O)C3=CC=C(S3)Cl)C

InChI

InChI=1S/C19H19ClN4O3S3/c1-12-10-13(2)22-19(21-12)28-15-6-4-14(5-7-15)23-17(25)11-24(3)30(26,27)18-9-8-16(20)29-18/h4-10H,11H2,1-3H3,(H,23,25)