3-methyl-N-[[6-methyl-2-(4-methylphenyl)benzotriazol-5-yl]carbamothioyl]butanamide

Systemtic Name: 3-methyl-N-[[6-methyl-2-(4-methylphenyl)benzotriazol-5-yl]carbamothioyl]butanamide Openeye Name: 3-methyl-N-[[6-methyl-2-(p-tolyl)benzotriazol-5-yl]carbamothioyl]butanamide CAS Name: 3-methyl-N-[[[6-methyl-2-(4-methylphenyl)-5-benzotriazolyl]amino]-sulfanylidenemethyl]butanamide IUPAC Name: 3-methyl-N-[[6-methyl-2-(4-methylphenyl)benzotriazol-5-yl]carbamothioyl]butanamide Traditional Name: 3-methyl-N-[[6-methyl-2-(p-tolyl)benzotriazol-5-yl]thiocarbamoyl]butyramide Formula: C20H23N5OS MolecularWeight: 381.49452

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)N2N=C3C=C(C(=CC3=N2)NC(=S)NC(=O)CC(C)C)C

Isomeric SMILES

CC1=CC=C(C=C1)N2N=C3C=C(C(=CC3=N2)NC(=S)NC(=O)CC(C)C)C

InChI

InChI=1S/C20H23N5OS/c1-12(2)9-19(26)22-20(27)21-16-11-18-17(10-14(16)4)23-25(24-18)15-7-5-13(3)6-8-15/h5-8,10-12H,9H2,1-4H3,(H2,21,22,26,27)