1-(4-ethanoylphenyl)-3-[1-[(4-methylphenyl)methyl]-1,2,4-triazol-3-yl]thiourea

Systemtic Name: 1-(4-ethanoylphenyl)-3-[1-[(4-methylphenyl)methyl]-1,2,4-triazol-3-yl]thiourea Openeye Name: 1-(4-acetylphenyl)-3-[1-(p-tolylmethyl)-1,2,4-triazol-3-yl]thiourea CAS Name: 1-(4-acetylphenyl)-3-[1-[(4-methylphenyl)methyl]-1,2,4-triazol-3-yl]thiourea IUPAC Name: 1-(4-acetylphenyl)-3-[1-[(4-methylphenyl)methyl]-1,2,4-triazol-3-yl]thiourea Traditional Name: 1-(4-acetylphenyl)-3-[1-(4-methylbenzyl)-1,2,4-triazol-3-yl]thiourea Formula: C19H19N5OS MolecularWeight: 365.45206

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)CN2C=NC(=N2)NC(=S)NC3=CC=C(C=C3)C(=O)C

Isomeric SMILES

CC1=CC=C(C=C1)CN2C=NC(=N2)NC(=S)NC3=CC=C(C=C3)C(=O)C

InChI

InChI=1S/C19H19N5OS/c1-13-3-5-15(6-4-13)11-24-12-20-18(23-24)22-19(26)21-17-9-7-16(8-10-17)14(2)25/h3-10,12H,11H2,1-2H3,(H2,21,22,23,26)