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

Systemtic Name: 1-[(E)-(1-methylpyrazol-4-yl)methylideneamino]-3-(phenylmethyl)thiourea Openeye Name: 1-benzyl-3-[(E)-(1-methylpyrazol-4-yl)methyleneamino]thiourea CAS Name: 1-[(E)-(1-methyl-4-pyrazolyl)methylideneamino]-3-(phenylmethyl)thiourea IUPAC Name: 1-benzyl-3-[(E)-(1-methylpyrazol-4-yl)methylideneamino]thiourea Traditional Name: 1-benzyl-3-[(E)-(1-methylpyrazol-4-yl)methyleneamino]thiourea Formula: C13H15N5S MolecularWeight: 273.3567

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

CN1C=C(C=N1)/C=N/NC(=S)NCC2=CC=CC=C2

InChI

InChI=1S/C13H15N5S/c1-18-10-12(9-16-18)8-15-17-13(19)14-7-11-5-3-2-4-6-11/h2-6,8-10H,7H2,1H3,(H2,14,17,19)/b15-8+