N-(1,3-benzothiazol-2-ylmethyl)-2-(2,4-dimethylphenyl)-N,5-dimethyl-1,2,3-triazole-4-carboxamide

Systemtic Name: N-(1,3-benzothiazol-2-ylmethyl)-2-(2,4-dimethylphenyl)-N,5-dimethyl-1,2,3-triazole-4-carboxamide Openeye Name: N-(1,3-benzothiazol-2-ylmethyl)-2-(2,4-dimethylphenyl)-N,5-dimethyl-triazole-4-carboxamide CAS Name: N-(1,3-benzothiazol-2-ylmethyl)-2-(2,4-dimethylphenyl)-N,5-dimethyl-4-triazolecarboxamide IUPAC Name: N-(1,3-benzothiazol-2-ylmethyl)-2-(2,4-dimethylphenyl)-N,5-dimethyltriazole-4-carboxamide Traditional Name: N-(1,3-benzothiazol-2-ylmethyl)-2-(2,4-dimethylphenyl)-N,5-dimethyl-triazole-4-carboxamide Formula: C21H21N5OS MolecularWeight: 391.48934

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)N2N=C(C(=N2)C(=O)N(C)CC3=NC4=CC=CC=C4S3)C)C

Isomeric SMILES

CC1=CC(=C(C=C1)N2N=C(C(=N2)C(=O)N(C)CC3=NC4=CC=CC=C4S3)C)C

InChI

InChI=1S/C21H21N5OS/c1-13-9-10-17(14(2)11-13)26-23-15(3)20(24-26)21(27)25(4)12-19-22-16-7-5-6-8-18(16)28-19/h5-11H,12H2,1-4H3