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

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

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Descriptors Computed from Structure

Canonical SMILES:

CC1CC1C(=O)NC2=NC3=C(S2)C=C(C=C3)C(=O)NC4=C(C=CC=C4C)C

Isomeric SMILES

CC1CC1C(=O)NC2=NC3=C(S2)C=C(C=C3)C(=O)NC4=C(C=CC=C4C)C

InChI

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