3-(4-methylphenyl)-N-(6-methylsulfonyl-1,3-benzothiazol-2-yl)thiophene-2-carboxamide

Systemtic Name: 3-(4-methylphenyl)-N-(6-methylsulfonyl-1,3-benzothiazol-2-yl)thiophene-2-carboxamide Openeye Name: N-(6-methylsulfonyl-1,3-benzothiazol-2-yl)-3-(p-tolyl)thiophene-2-carboxamide CAS Name: 3-(4-methylphenyl)-N-(6-methylsulfonyl-1,3-benzothiazol-2-yl)-2-thiophenecarboxamide IUPAC Name: 3-(4-methylphenyl)-N-(6-methylsulfonyl-1,3-benzothiazol-2-yl)thiophene-2-carboxamide Traditional Name: N-(6-mesyl-1,3-benzothiazol-2-yl)-3-(p-tolyl)thiophene-2-carboxamide Formula: C20H16N2O3S3 MolecularWeight: 428.54764

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=C(SC=C2)C(=O)NC3=NC4=C(S3)C=C(C=C4)S(=O)(=O)C

Isomeric SMILES

CC1=CC=C(C=C1)C2=C(SC=C2)C(=O)NC3=NC4=C(S3)C=C(C=C4)S(=O)(=O)C

InChI

InChI=1S/C20H16N2O3S3/c1-12-3-5-13(6-4-12)15-9-10-26-18(15)19(23)22-20-21-16-8-7-14(28(2,24)25)11-17(16)27-20/h3-11H,1-2H3,(H,21,22,23)