1-(phenylmethyl)-3-[(Z)-(1-phenyl-3-pyridin-3-yl-pyrazol-4-yl)methylideneamino]thiourea

Systemtic Name: 1-(phenylmethyl)-3-[(Z)-(1-phenyl-3-pyridin-3-yl-pyrazol-4-yl)methylideneamino]thiourea Openeye Name: 1-benzyl-3-[(Z)-[1-phenyl-3-(3-pyridyl)pyrazol-4-yl]methyleneamino]thiourea CAS Name: 1-(phenylmethyl)-3-[(Z)-[1-phenyl-3-(3-pyridinyl)-4-pyrazolyl]methylideneamino]thiourea IUPAC Name: 1-benzyl-3-[(Z)-(1-phenyl-3-pyridin-3-ylpyrazol-4-yl)methylideneamino]thiourea Traditional Name: 1-benzyl-3-[(Z)-[1-phenyl-3-(3-pyridyl)pyrazol-4-yl]methyleneamino]thiourea Formula: C23H20N6S MolecularWeight: 412.5101

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CNC(=S)NN=CC2=CN(N=C2C3=CN=CC=C3)C4=CC=CC=C4

Isomeric SMILES

C1=CC=C(C=C1)CNC(=S)N/N=C\C2=CN(N=C2C3=CN=CC=C3)C4=CC=CC=C4

InChI

InChI=1S/C23H20N6S/c30-23(25-14-18-8-3-1-4-9-18)27-26-16-20-17-29(21-11-5-2-6-12-21)28-22(20)19-10-7-13-24-15-19/h1-13,15-17H,14H2,(H2,25,27,30)/b26-16-