4-[(4-methoxyphenyl)sulfonyl-methyl-amino]-N-(4-methyl-1,3-benzothiazol-2-yl)butanamide

Systemtic Name: 4-[(4-methoxyphenyl)sulfonyl-methyl-amino]-N-(4-methyl-1,3-benzothiazol-2-yl)butanamide Openeye Name: 4-[(4-methoxyphenyl)sulfonyl-methyl-amino]-N-(4-methyl-1,3-benzothiazol-2-yl)butanamide CAS Name: 4-[(4-methoxyphenyl)sulfonyl-methylamino]-N-(4-methyl-1,3-benzothiazol-2-yl)butanamide IUPAC Name: 4-[(4-methoxyphenyl)sulfonyl-methylamino]-N-(4-methyl-1,3-benzothiazol-2-yl)butanamide Traditional Name: 4-[(4-methoxyphenyl)sulfonyl-methyl-amino]-N-(4-methyl-1,3-benzothiazol-2-yl)butyramide Formula: C20H23N3O4S2 MolecularWeight: 433.54432

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C2C(=CC=C1)SC(=N2)NC(=O)CCCN(C)S(=O)(=O)C3=CC=C(C=C3)OC

Isomeric SMILES

CC1=C2C(=CC=C1)SC(=N2)NC(=O)CCCN(C)S(=O)(=O)C3=CC=C(C=C3)OC

InChI

InChI=1S/C20H23N3O4S2/c1-14-6-4-7-17-19(14)22-20(28-17)21-18(24)8-5-13-23(2)29(25,26)16-11-9-15(27-3)10-12-16/h4,6-7,9-12H,5,8,13H2,1-3H3,(H,21,22,24)