2-(cyclopropylcarbonylamino)-N-(2,4,6-trimethylphenyl)-1,3-benzothiazole-6-carboxamide

Systemtic Name: 2-(cyclopropylcarbonylamino)-N-(2,4,6-trimethylphenyl)-1,3-benzothiazole-6-carboxamide Openeye Name: 2-(cyclopropanecarbonylamino)-N-(2,4,6-trimethylphenyl)-1,3-benzothiazole-6-carboxamide CAS Name: 2-[[cyclopropyl(oxo)methyl]amino]-N-(2,4,6-trimethylphenyl)-1,3-benzothiazole-6-carboxamide IUPAC Name: 2-(cyclopropanecarbonylamino)-N-(2,4,6-trimethylphenyl)-1,3-benzothiazole-6-carboxamide Traditional Name: 2-(cyclopropanecarbonylamino)-N-mesityl-1,3-benzothiazole-6-carboxamide Formula: C21H21N3O2S MolecularWeight: 379.47534

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C(=C1)C)NC(=O)C2=CC3=C(C=C2)N=C(S3)NC(=O)C4CC4)C

Isomeric SMILES

CC1=CC(=C(C(=C1)C)NC(=O)C2=CC3=C(C=C2)N=C(S3)NC(=O)C4CC4)C

InChI

InChI=1S/C21H21N3O2S/c1-11-8-12(2)18(13(3)9-11)23-20(26)15-6-7-16-17(10-15)27-21(22-16)24-19(25)14-4-5-14/h6-10,14H,4-5H2,1-3H3,(H,23,26)(H,22,24,25)