4-methyl-2-[4-(phenylazanylmethyl)-1,2,3-triazol-1-yl]-N-(phenylmethyl)-1,3-thiazole-5-carboxamide

Systemtic Name: 4-methyl-2-[4-(phenylazanylmethyl)-1,2,3-triazol-1-yl]-N-(phenylmethyl)-1,3-thiazole-5-carboxamide Openeye Name: 2-[4-(anilinomethyl)triazol-1-yl]-N-benzyl-4-methyl-thiazole-5-carboxamide CAS Name: 2-[4-(anilinomethyl)-1-triazolyl]-4-methyl-N-(phenylmethyl)-5-thiazolecarboxamide IUPAC Name: 2-[4-(anilinomethyl)triazol-1-yl]-N-benzyl-4-methyl-1,3-thiazole-5-carboxamide Traditional Name: 2-[4-(anilinomethyl)triazol-1-yl]-N-benzyl-4-methyl-thiazole-5-carboxamide Formula: C21H20N6OS MolecularWeight: 404.4881

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC(=N1)N2C=C(N=N2)CNC3=CC=CC=C3)C(=O)NCC4=CC=CC=C4

Isomeric SMILES

CC1=C(SC(=N1)N2C=C(N=N2)CNC3=CC=CC=C3)C(=O)NCC4=CC=CC=C4

InChI

InChI=1S/C21H20N6OS/c1-15-19(20(28)23-12-16-8-4-2-5-9-16)29-21(24-15)27-14-18(25-26-27)13-22-17-10-6-3-7-11-17/h2-11,14,22H,12-13H2,1H3,(H,23,28)