1-[[(E)-(3-methyl-5-oxidanylidene-1-phenyl-pyrazol-4-ylidene)methyl]amino]-3-phenyl-thiourea

Systemtic Name: 1-[[(E)-(3-methyl-5-oxidanylidene-1-phenyl-pyrazol-4-ylidene)methyl]amino]-3-phenyl-thiourea Openeye Name: 1-[[(E)-(3-methyl-5-oxo-1-phenyl-pyrazol-4-ylidene)methyl]amino]-3-phenyl-thiourea CAS Name: 1-[[(E)-(3-methyl-5-oxo-1-phenyl-4-pyrazolylidene)methyl]amino]-3-phenylthiourea IUPAC Name: 1-[[(E)-(3-methyl-5-oxo-1-phenylpyrazol-4-ylidene)methyl]amino]-3-phenylthiourea Traditional Name: 1-[[(E)-(5-keto-3-methyl-1-phenyl-2-pyrazolin-4-ylidene)methyl]amino]-3-phenyl-thiourea Formula: C18H17N5OS MolecularWeight: 351.42548

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C(=O)C1=CNNC(=S)NC2=CC=CC=C2)C3=CC=CC=C3

Isomeric SMILES

CC\1=NN(C(=O)/C1=C/NNC(=S)NC2=CC=CC=C2)C3=CC=CC=C3

InChI

InChI=1S/C18H17N5OS/c1-13-16(17(24)23(22-13)15-10-6-3-7-11-15)12-19-21-18(25)20-14-8-4-2-5-9-14/h2-12,19H,1H3,(H2,20,21,25)/b16-12+