N-(2-chloranyl-6-methyl-phenyl)-2-(cyclobutylcarbonylamino)-1,3-benzothiazole-6-carboxamide

Systemtic Name: N-(2-chloranyl-6-methyl-phenyl)-2-(cyclobutylcarbonylamino)-1,3-benzothiazole-6-carboxamide Openeye Name: N-(2-chloro-6-methyl-phenyl)-2-(cyclobutanecarbonylamino)-1,3-benzothiazole-6-carboxamide CAS Name: N-(2-chloro-6-methylphenyl)-2-[[cyclobutyl(oxo)methyl]amino]-1,3-benzothiazole-6-carboxamide IUPAC Name: N-(2-chloro-6-methylphenyl)-2-(cyclobutanecarbonylamino)-1,3-benzothiazole-6-carboxamide Traditional Name: N-(2-chloro-6-methyl-phenyl)-2-(cyclobutanecarbonylamino)-1,3-benzothiazole-6-carboxamide Formula: C20H18ClN3O2S MolecularWeight: 399.89382

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC=C1)Cl)NC(=O)C2=CC3=C(C=C2)N=C(S3)NC(=O)C4CCC4

Isomeric SMILES

CC1=C(C(=CC=C1)Cl)NC(=O)C2=CC3=C(C=C2)N=C(S3)NC(=O)C4CCC4

InChI

InChI=1S/C20H18ClN3O2S/c1-11-4-2-7-14(21)17(11)23-19(26)13-8-9-15-16(10-13)27-20(22-15)24-18(25)12-5-3-6-12/h2,4,7-10,12H,3,5-6H2,1H3,(H,23,26)(H,22,24,25)