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

Systemtic Name: 1-(1,5-dimethyl-3-oxidanylidene-2-phenyl-pyrazol-4-yl)-3-(4-methylpiperazin-1-yl)thiourea Openeye Name: 1-(1,5-dimethyl-3-oxo-2-phenyl-pyrazol-4-yl)-3-(4-methylpiperazin-1-yl)thiourea CAS Name: 1-(1,5-dimethyl-3-oxo-2-phenyl-4-pyrazolyl)-3-(4-methyl-1-piperazinyl)thiourea IUPAC Name: 1-(1,5-dimethyl-3-oxo-2-phenylpyrazol-4-yl)-3-(4-methylpiperazin-1-yl)thiourea Traditional Name: 1-(3-keto-1,5-dimethyl-2-phenyl-3-pyrazolin-4-yl)-3-(4-methylpiperazino)thiourea Formula: C17H24N6OS MolecularWeight: 360.47706

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=O)N(N1C)C2=CC=CC=C2)NC(=S)NN3CCN(CC3)C

Isomeric SMILES

CC1=C(C(=O)N(N1C)C2=CC=CC=C2)NC(=S)NN3CCN(CC3)C

InChI

InChI=1S/C17H24N6OS/c1-13-15(18-17(25)19-22-11-9-20(2)10-12-22)16(24)23(21(13)3)14-7-5-4-6-8-14/h4-8H,9-12H2,1-3H3,(H2,18,19,25)