1-cyclohexyl-3-[(E)-[1-(phenylmethyl)-3-pyridin-3-yl-pyrazol-4-yl]methylideneamino]thiourea

Systemtic Name: 1-cyclohexyl-3-[(E)-[1-(phenylmethyl)-3-pyridin-3-yl-pyrazol-4-yl]methylideneamino]thiourea Openeye Name: 1-[(E)-[1-benzyl-3-(3-pyridyl)pyrazol-4-yl]methyleneamino]-3-cyclohexyl-thiourea CAS Name: 1-cyclohexyl-3-[(E)-[1-(phenylmethyl)-3-(3-pyridinyl)-4-pyrazolyl]methylideneamino]thiourea IUPAC Name: 1-[(E)-(1-benzyl-3-pyridin-3-ylpyrazol-4-yl)methylideneamino]-3-cyclohexylthiourea Traditional Name: 1-[(E)-[1-benzyl-3-(3-pyridyl)pyrazol-4-yl]methyleneamino]-3-cyclohexyl-thiourea Formula: C23H26N6S MolecularWeight: 418.55774

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)NC(=S)NN=CC2=CN(N=C2C3=CN=CC=C3)CC4=CC=CC=C4

Isomeric SMILES

C1CCC(CC1)NC(=S)N/N=C/C2=CN(N=C2C3=CN=CC=C3)CC4=CC=CC=C4

InChI

InChI=1S/C23H26N6S/c30-23(26-21-11-5-2-6-12-21)27-25-15-20-17-29(16-18-8-3-1-4-9-18)28-22(20)19-10-7-13-24-14-19/h1,3-4,7-10,13-15,17,21H,2,5-6,11-12,16H2,(H2,26,27,30)/b25-15+