1-cyclohexyl-3-[(Z)-(1-phenyl-3-thiophen-2-yl-pyrazol-4-yl)methylideneamino]thiourea

Systemtic Name: 1-cyclohexyl-3-[(Z)-(1-phenyl-3-thiophen-2-yl-pyrazol-4-yl)methylideneamino]thiourea Openeye Name: 1-cyclohexyl-3-[(Z)-[1-phenyl-3-(2-thienyl)pyrazol-4-yl]methyleneamino]thiourea CAS Name: 1-cyclohexyl-3-[(Z)-(1-phenyl-3-thiophen-2-yl-4-pyrazolyl)methylideneamino]thiourea IUPAC Name: 1-cyclohexyl-3-[(Z)-(1-phenyl-3-thiophen-2-ylpyrazol-4-yl)methylideneamino]thiourea Traditional Name: 1-cyclohexyl-3-[(Z)-[1-phenyl-3-(2-thienyl)pyrazol-4-yl]methyleneamino]thiourea Formula: C21H23N5S2 MolecularWeight: 409.57082

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)NC(=S)NN=CC2=CN(N=C2C3=CC=CS3)C4=CC=CC=C4

Isomeric SMILES

C1CCC(CC1)NC(=S)N/N=C\C2=CN(N=C2C3=CC=CS3)C4=CC=CC=C4

InChI

InChI=1S/C21H23N5S2/c27-21(23-17-8-3-1-4-9-17)24-22-14-16-15-26(18-10-5-2-6-11-18)25-20(16)19-12-7-13-28-19/h2,5-7,10-15,17H,1,3-4,8-9H2,(H2,23,24,27)/b22-14-