N-(1,3-benzothiazol-2-ylmethyl)-3-[(2,5-dimethylphenyl)sulfonylamino]benzamide

Systemtic Name: N-(1,3-benzothiazol-2-ylmethyl)-3-[(2,5-dimethylphenyl)sulfonylamino]benzamide Openeye Name: N-(1,3-benzothiazol-2-ylmethyl)-3-[(2,5-dimethylphenyl)sulfonylamino]benzamide CAS Name: N-(1,3-benzothiazol-2-ylmethyl)-3-[(2,5-dimethylphenyl)sulfonylamino]benzamide IUPAC Name: N-(1,3-benzothiazol-2-ylmethyl)-3-[(2,5-dimethylphenyl)sulfonylamino]benzamide Traditional Name: N-(1,3-benzothiazol-2-ylmethyl)-3-[(2,5-dimethylphenyl)sulfonylamino]benzamide Formula: C23H21N3O3S2 MolecularWeight: 451.56114

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C)S(=O)(=O)NC2=CC=CC(=C2)C(=O)NCC3=NC4=CC=CC=C4S3

Isomeric SMILES

CC1=CC(=C(C=C1)C)S(=O)(=O)NC2=CC=CC(=C2)C(=O)NCC3=NC4=CC=CC=C4S3

InChI

InChI=1S/C23H21N3O3S2/c1-15-10-11-16(2)21(12-15)31(28,29)26-18-7-5-6-17(13-18)23(27)24-14-22-25-19-8-3-4-9-20(19)30-22/h3-13,26H,14H2,1-2H3,(H,24,27)