2-[(4-cyanophenyl)sulfonyl-methyl-amino]-N-(4,7-dimethyl-1,3-benzothiazol-2-yl)ethanamide

Systemtic Name: 2-[(4-cyanophenyl)sulfonyl-methyl-amino]-N-(4,7-dimethyl-1,3-benzothiazol-2-yl)ethanamide Openeye Name: 2-[(4-cyanophenyl)sulfonyl-methyl-amino]-N-(4,7-dimethyl-1,3-benzothiazol-2-yl)acetamide CAS Name: 2-[(4-cyanophenyl)sulfonyl-methylamino]-N-(4,7-dimethyl-1,3-benzothiazol-2-yl)acetamide IUPAC Name: 2-[(4-cyanophenyl)sulfonyl-methylamino]-N-(4,7-dimethyl-1,3-benzothiazol-2-yl)acetamide Traditional Name: 2-[(4-cyanophenyl)sulfonyl-methyl-amino]-N-(4,7-dimethyl-1,3-benzothiazol-2-yl)acetamide Formula: C19H18N4O3S2 MolecularWeight: 414.50122

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C2C(=C(C=C1)C)SC(=N2)NC(=O)CN(C)S(=O)(=O)C3=CC=C(C=C3)C#N

Isomeric SMILES

CC1=C2C(=C(C=C1)C)SC(=N2)NC(=O)CN(C)S(=O)(=O)C3=CC=C(C=C3)C#N

InChI

InChI=1S/C19H18N4O3S2/c1-12-4-5-13(2)18-17(12)22-19(27-18)21-16(24)11-23(3)28(25,26)15-8-6-14(10-20)7-9-15/h4-9H,11H2,1-3H3,(H,21,22,24)