N-(2-methyl-1,3-benzothiazol-6-yl)-1-(phenylmethyl)-1,2,3-triazole-4-carboxamide

Systemtic Name: N-(2-methyl-1,3-benzothiazol-6-yl)-1-(phenylmethyl)-1,2,3-triazole-4-carboxamide Openeye Name: 1-benzyl-N-(2-methyl-1,3-benzothiazol-6-yl)triazole-4-carboxamide CAS Name: N-(2-methyl-1,3-benzothiazol-6-yl)-1-(phenylmethyl)-4-triazolecarboxamide IUPAC Name: 1-benzyl-N-(2-methyl-1,3-benzothiazol-6-yl)triazole-4-carboxamide Traditional Name: 1-benzyl-N-(2-methyl-1,3-benzothiazol-6-yl)triazole-4-carboxamide Formula: C18H15N5OS MolecularWeight: 349.4096

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC2=C(S1)C=C(C=C2)NC(=O)C3=CN(N=N3)CC4=CC=CC=C4

Isomeric SMILES

CC1=NC2=C(S1)C=C(C=C2)NC(=O)C3=CN(N=N3)CC4=CC=CC=C4

InChI

InChI=1S/C18H15N5OS/c1-12-19-15-8-7-14(9-17(15)25-12)20-18(24)16-11-23(22-21-16)10-13-5-3-2-4-6-13/h2-9,11H,10H2,1H3,(H,20,24)