1-(3,5-dimethyl-1,2,4-triazol-4-yl)-3-phenyl-thiourea

Systemtic Name: 1-(3,5-dimethyl-1,2,4-triazol-4-yl)-3-phenyl-thiourea Openeye Name: 1-(3,5-dimethyl-1,2,4-triazol-4-yl)-3-phenyl-thiourea CAS Name: 1-(3,5-dimethyl-1,2,4-triazol-4-yl)-3-phenylthiourea IUPAC Name: 1-(3,5-dimethyl-1,2,4-triazol-4-yl)-3-phenylthiourea Traditional Name: 1-(3,5-dimethyl-1,2,4-triazol-4-yl)-3-phenyl-thiourea Formula: C11H13N5S MolecularWeight: 247.31942

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN=C(N1NC(=S)NC2=CC=CC=C2)C

Isomeric SMILES

CC1=NN=C(N1NC(=S)NC2=CC=CC=C2)C

InChI

InChI=1S/C11H13N5S/c1-8-13-14-9(2)16(8)15-11(17)12-10-6-4-3-5-7-10/h3-7H,1-2H3,(H2,12,15,17)