N-(2,6-dimethylphenyl)-2-[(1-methylcyclopropyl)carbonylamino]-1,3-benzothiazole-6-carboxamide

Systemtic Name: N-(2,6-dimethylphenyl)-2-[(1-methylcyclopropyl)carbonylamino]-1,3-benzothiazole-6-carboxamide Openeye Name: N-(2,6-dimethylphenyl)-2-[(1-methylcyclopropanecarbonyl)amino]-1,3-benzothiazole-6-carboxamide CAS Name: N-(2,6-dimethylphenyl)-2-[[(1-methylcyclopropyl)-oxomethyl]amino]-1,3-benzothiazole-6-carboxamide IUPAC Name: N-(2,6-dimethylphenyl)-2-[(1-methylcyclopropanecarbonyl)amino]-1,3-benzothiazole-6-carboxamide Traditional Name: N-(2,6-dimethylphenyl)-2-[(1-methylcyclopropanecarbonyl)amino]-1,3-benzothiazole-6-carboxamide Formula: C21H21N3O2S MolecularWeight: 379.47534

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC=C1)C)NC(=O)C2=CC3=C(C=C2)N=C(S3)NC(=O)C4(CC4)C

Isomeric SMILES

CC1=C(C(=CC=C1)C)NC(=O)C2=CC3=C(C=C2)N=C(S3)NC(=O)C4(CC4)C

InChI

InChI=1S/C21H21N3O2S/c1-12-5-4-6-13(2)17(12)23-18(25)14-7-8-15-16(11-14)27-20(22-15)24-19(26)21(3)9-10-21/h4-8,11H,9-10H2,1-3H3,(H,23,25)(H,22,24,26)