3-azanyl-1-(1,5-dimethyl-3-oxidanylidene-2-phenyl-pyrazol-4-yl)-1-methyl-thiourea

Systemtic Name: 3-azanyl-1-(1,5-dimethyl-3-oxidanylidene-2-phenyl-pyrazol-4-yl)-1-methyl-thiourea Openeye Name: 3-amino-1-(1,5-dimethyl-3-oxo-2-phenyl-pyrazol-4-yl)-1-methyl-thiourea CAS Name: 3-amino-1-(1,5-dimethyl-3-oxo-2-phenyl-4-pyrazolyl)-1-methylthiourea IUPAC Name: 3-amino-1-(1,5-dimethyl-3-oxo-2-phenylpyrazol-4-yl)-1-methylthiourea Traditional Name: 3-amino-1-(3-keto-1,5-dimethyl-2-phenyl-3-pyrazolin-4-yl)-1-methyl-thiourea Formula: C13H17N5OS MolecularWeight: 291.37198

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=O)N(N1C)C2=CC=CC=C2)N(C)C(=S)NN

Isomeric SMILES

CC1=C(C(=O)N(N1C)C2=CC=CC=C2)N(C)C(=S)NN

InChI

InChI=1S/C13H17N5OS/c1-9-11(16(2)13(20)15-14)12(19)18(17(9)3)10-7-5-4-6-8-10/h4-8H,14H2,1-3H3,(H,15,20)