1-cyclohexyl-3-[(E)-[3-(4-nitrophenyl)-1-phenyl-pyrazol-4-yl]methylideneamino]thiourea

Systemtic Name: 1-cyclohexyl-3-[(E)-[3-(4-nitrophenyl)-1-phenyl-pyrazol-4-yl]methylideneamino]thiourea Openeye Name: 1-cyclohexyl-3-[(E)-[3-(4-nitrophenyl)-1-phenyl-pyrazol-4-yl]methyleneamino]thiourea CAS Name: 1-cyclohexyl-3-[(E)-[3-(4-nitrophenyl)-1-phenyl-4-pyrazolyl]methylideneamino]thiourea IUPAC Name: 1-cyclohexyl-3-[(E)-[3-(4-nitrophenyl)-1-phenylpyrazol-4-yl]methylideneamino]thiourea Traditional Name: 1-cyclohexyl-3-[(E)-[3-(4-nitrophenyl)-1-phenyl-pyrazol-4-yl]methyleneamino]thiourea Formula: C23H24N6O2S MolecularWeight: 448.54066

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)NC(=S)NN=CC2=CN(N=C2C3=CC=C(C=C3)[N+](=O)[O-])C4=CC=CC=C4

Isomeric SMILES

C1CCC(CC1)NC(=S)N/N=C/C2=CN(N=C2C3=CC=C(C=C3)[N+](=O)[O-])C4=CC=CC=C4

InChI

InChI=1S/C23H24N6O2S/c30-29(31)21-13-11-17(12-14-21)22-18(16-28(27-22)20-9-5-2-6-10-20)15-24-26-23(32)25-19-7-3-1-4-8-19/h2,5-6,9-16,19H,1,3-4,7-8H2,(H2,25,26,32)/b24-15+