1-(phenylmethyl)-N-(4-phenyl-1,3-thiazol-2-yl)-N-prop-2-enyl-1,2,3-triazole-4-carboxamide

Systemtic Name: 1-(phenylmethyl)-N-(4-phenyl-1,3-thiazol-2-yl)-N-prop-2-enyl-1,2,3-triazole-4-carboxamide Openeye Name: N-allyl-1-benzyl-N-(4-phenylthiazol-2-yl)triazole-4-carboxamide CAS Name: 1-(phenylmethyl)-N-(4-phenyl-2-thiazolyl)-N-prop-2-enyl-4-triazolecarboxamide IUPAC Name: 1-benzyl-N-(4-phenyl-1,3-thiazol-2-yl)-N-prop-2-enyltriazole-4-carboxamide Traditional Name: N-allyl-1-benzyl-N-(4-phenylthiazol-2-yl)triazole-4-carboxamide Formula: C22H19N5OS MolecularWeight: 401.48416

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Descriptors Computed from Structure

Canonical SMILES:

C=CCN(C1=NC(=CS1)C2=CC=CC=C2)C(=O)C3=CN(N=N3)CC4=CC=CC=C4

Isomeric SMILES

C=CCN(C1=NC(=CS1)C2=CC=CC=C2)C(=O)C3=CN(N=N3)CC4=CC=CC=C4

InChI

InChI=1S/C22H19N5OS/c1-2-13-27(22-23-20(16-29-22)18-11-7-4-8-12-18)21(28)19-15-26(25-24-19)14-17-9-5-3-6-10-17/h2-12,15-16H,1,13-14H2