1-(1,2-dimethyl-3-oxidanylidene-5-phenyl-pyrazol-4-yl)-3-prop-2-enyl-thiourea

Systemtic Name: 1-(1,2-dimethyl-3-oxidanylidene-5-phenyl-pyrazol-4-yl)-3-prop-2-enyl-thiourea Openeye Name: 1-allyl-3-(1,2-dimethyl-3-oxo-5-phenyl-pyrazol-4-yl)thiourea CAS Name: 1-(1,2-dimethyl-3-oxo-5-phenyl-4-pyrazolyl)-3-prop-2-enylthiourea IUPAC Name: 1-(1,2-dimethyl-3-oxo-5-phenylpyrazol-4-yl)-3-prop-2-enylthiourea Traditional Name: 1-allyl-3-(3-keto-1,2-dimethyl-5-phenyl-3-pyrazolin-4-yl)thiourea Formula: C15H18N4OS MolecularWeight: 302.39462

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=C(C(=O)N1C)NC(=S)NCC=C)C2=CC=CC=C2

Isomeric SMILES

CN1C(=C(C(=O)N1C)NC(=S)NCC=C)C2=CC=CC=C2

InChI

InChI=1S/C15H18N4OS/c1-4-10-16-15(21)17-12-13(11-8-6-5-7-9-11)18(2)19(3)14(12)20/h4-9H,1,10H2,2-3H3,(H2,16,17,21)