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

Systemtic Name: N-(2-chloranyl-6-methyl-phenyl)-2-(cyclopentylcarbonylamino)-1,3-benzothiazole-6-carboxamide Openeye Name: N-(2-chloro-6-methyl-phenyl)-2-(cyclopentanecarbonylamino)-1,3-benzothiazole-6-carboxamide CAS Name: N-(2-chloro-6-methylphenyl)-2-[[cyclopentyl(oxo)methyl]amino]-1,3-benzothiazole-6-carboxamide IUPAC Name: N-(2-chloro-6-methylphenyl)-2-(cyclopentanecarbonylamino)-1,3-benzothiazole-6-carboxamide Traditional Name: N-(2-chloro-6-methyl-phenyl)-2-(cyclopentanecarbonylamino)-1,3-benzothiazole-6-carboxamide Formula: C21H20ClN3O2S MolecularWeight: 413.9204

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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)C4CCCC4

Isomeric SMILES

CC1=C(C(=CC=C1)Cl)NC(=O)C2=CC3=C(C=C2)N=C(S3)NC(=O)C4CCCC4

InChI

InChI=1S/C21H20ClN3O2S/c1-12-5-4-8-15(22)18(12)24-20(27)14-9-10-16-17(11-14)28-21(23-16)25-19(26)13-6-2-3-7-13/h4-5,8-11,13H,2-3,6-7H2,1H3,(H,24,27)(H,23,25,26)