3-[(5-methylsulfanyl-4-propan-2-yl-1,2,4-triazol-3-yl)methyl]-1,1-diphenyl-urea

Systemtic Name: 3-[(5-methylsulfanyl-4-propan-2-yl-1,2,4-triazol-3-yl)methyl]-1,1-diphenyl-urea Openeye Name: 3-[(4-isopropyl-5-methylsulfanyl-1,2,4-triazol-3-yl)methyl]-1,1-diphenyl-urea CAS Name: 3-[[5-(methylthio)-4-propan-2-yl-1,2,4-triazol-3-yl]methyl]-1,1-diphenylurea IUPAC Name: 3-[(5-methylsulfanyl-4-propan-2-yl-1,2,4-triazol-3-yl)methyl]-1,1-diphenylurea Traditional Name: 3-[[4-isopropyl-5-(methylthio)-1,2,4-triazol-3-yl]methyl]-1,1-diphenyl-urea Formula: C20H23N5OS MolecularWeight: 381.49452

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)N1C(=NN=C1SC)CNC(=O)N(C2=CC=CC=C2)C3=CC=CC=C3

Isomeric SMILES

CC(C)N1C(=NN=C1SC)CNC(=O)N(C2=CC=CC=C2)C3=CC=CC=C3

InChI

InChI=1S/C20H23N5OS/c1-15(2)24-18(22-23-20(24)27-3)14-21-19(26)25(16-10-6-4-7-11-16)17-12-8-5-9-13-17/h4-13,15H,14H2,1-3H3,(H,21,26)