2-[[5-methyl-4-(phenylmethyl)-1,2,4-triazol-3-yl]sulfanyl]-N-(4-phenylazanylphenyl)-N-propan-2-yl-ethanamide

Systemtic Name: 2-[[5-methyl-4-(phenylmethyl)-1,2,4-triazol-3-yl]sulfanyl]-N-(4-phenylazanylphenyl)-N-propan-2-yl-ethanamide Openeye Name: N-(4-anilinophenyl)-2-[(4-benzyl-5-methyl-1,2,4-triazol-3-yl)sulfanyl]-N-isopropyl-acetamide CAS Name: N-(4-anilinophenyl)-2-[[5-methyl-4-(phenylmethyl)-1,2,4-triazol-3-yl]thio]-N-propan-2-ylacetamide IUPAC Name: N-(4-anilinophenyl)-2-[(4-benzyl-5-methyl-1,2,4-triazol-3-yl)sulfanyl]-N-propan-2-ylacetamide Traditional Name: N-(4-anilinophenyl)-2-[(4-benzyl-5-methyl-1,2,4-triazol-3-yl)thio]-N-isopropyl-acetamide Formula: C27H29N5OS MolecularWeight: 471.61706

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN=C(N1CC2=CC=CC=C2)SCC(=O)N(C3=CC=C(C=C3)NC4=CC=CC=C4)C(C)C

Isomeric SMILES

CC1=NN=C(N1CC2=CC=CC=C2)SCC(=O)N(C3=CC=C(C=C3)NC4=CC=CC=C4)C(C)C

InChI

InChI=1S/C27H29N5OS/c1-20(2)32(25-16-14-24(15-17-25)28-23-12-8-5-9-13-23)26(33)19-34-27-30-29-21(3)31(27)18-22-10-6-4-7-11-22/h4-17,20,28H,18-19H2,1-3H3