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

Systemtic Name: 1-ethyl-3-[[(3-methyl-5-oxidanylidene-1-phenyl-pyrazol-4-ylidene)-phenyl-methyl]amino]thiourea Openeye Name: 1-ethyl-3-[[(3-methyl-5-oxo-1-phenyl-pyrazol-4-ylidene)-phenyl-methyl]amino]thiourea CAS Name: 1-ethyl-3-[[(3-methyl-5-oxo-1-phenyl-4-pyrazolylidene)-phenylmethyl]amino]thiourea IUPAC Name: 1-ethyl-3-[[(3-methyl-5-oxo-1-phenylpyrazol-4-ylidene)-phenylmethyl]amino]thiourea Traditional Name: 1-ethyl-3-[[(5-keto-3-methyl-1-phenyl-2-pyrazolin-4-ylidene)-phenyl-methyl]amino]thiourea Formula: C20H21N5OS MolecularWeight: 379.47864

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Descriptors Computed from Structure

Canonical SMILES:

CCNC(=S)NNC(=C1C(=NN(C1=O)C2=CC=CC=C2)C)C3=CC=CC=C3

Isomeric SMILES

CCNC(=S)NNC(=C1C(=NN(C1=O)C2=CC=CC=C2)C)C3=CC=CC=C3

InChI

InChI=1S/C20H21N5OS/c1-3-21-20(27)23-22-18(15-10-6-4-7-11-15)17-14(2)24-25(19(17)26)16-12-8-5-9-13-16/h4-13,22H,3H2,1-2H3,(H2,21,23,27)