1-[(1-methylpyrazol-4-yl)methyl]-3-(phenylmethyl)thiourea

Systemtic Name: 1-[(1-methylpyrazol-4-yl)methyl]-3-(phenylmethyl)thiourea Openeye Name: 1-benzyl-3-[(1-methylpyrazol-4-yl)methyl]thiourea CAS Name: 1-[(1-methyl-4-pyrazolyl)methyl]-3-(phenylmethyl)thiourea IUPAC Name: 1-benzyl-3-[(1-methylpyrazol-4-yl)methyl]thiourea Traditional Name: 1-benzyl-3-[(1-methylpyrazol-4-yl)methyl]thiourea Formula: C13H16N4S MolecularWeight: 260.35794

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=C(C=N1)CNC(=S)NCC2=CC=CC=C2

Isomeric SMILES

CN1C=C(C=N1)CNC(=S)NCC2=CC=CC=C2

InChI

InChI=1S/C13H16N4S/c1-17-10-12(9-16-17)8-15-13(18)14-7-11-5-3-2-4-6-11/h2-6,9-10H,7-8H2,1H3,(H2,14,15,18)