1-(phenylmethyl)-N-(4,5,6,7-tetrahydro-1,3-benzothiazol-2-yl)-1,2,3-triazole-4-carboxamide

Systemtic Name: 1-(phenylmethyl)-N-(4,5,6,7-tetrahydro-1,3-benzothiazol-2-yl)-1,2,3-triazole-4-carboxamide Openeye Name: 1-benzyl-N-(4,5,6,7-tetrahydro-1,3-benzothiazol-2-yl)triazole-4-carboxamide CAS Name: 1-(phenylmethyl)-N-(4,5,6,7-tetrahydro-1,3-benzothiazol-2-yl)-4-triazolecarboxamide IUPAC Name: 1-benzyl-N-(4,5,6,7-tetrahydro-1,3-benzothiazol-2-yl)triazole-4-carboxamide Traditional Name: 1-benzyl-N-(4,5,6,7-tetrahydro-1,3-benzothiazol-2-yl)triazole-4-carboxamide Formula: C17H17N5OS MolecularWeight: 339.41478

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC2=C(C1)N=C(S2)NC(=O)C3=CN(N=N3)CC4=CC=CC=C4

Isomeric SMILES

C1CCC2=C(C1)N=C(S2)NC(=O)C3=CN(N=N3)CC4=CC=CC=C4

InChI

InChI=1S/C17H17N5OS/c23-16(19-17-18-13-8-4-5-9-15(13)24-17)14-11-22(21-20-14)10-12-6-2-1-3-7-12/h1-3,6-7,11H,4-5,8-10H2,(H,18,19,23)