1-[(Z)-[3-(3,4-dimethoxyphenyl)-1-phenyl-pyrazol-4-yl]methylideneamino]-3-methyl-thiourea

Systemtic Name: 1-[(Z)-[3-(3,4-dimethoxyphenyl)-1-phenyl-pyrazol-4-yl]methylideneamino]-3-methyl-thiourea Openeye Name: 1-[(Z)-[3-(3,4-dimethoxyphenyl)-1-phenyl-pyrazol-4-yl]methyleneamino]-3-methyl-thiourea CAS Name: 1-[(Z)-[3-(3,4-dimethoxyphenyl)-1-phenyl-4-pyrazolyl]methylideneamino]-3-methylthiourea IUPAC Name: 1-[(Z)-[3-(3,4-dimethoxyphenyl)-1-phenylpyrazol-4-yl]methylideneamino]-3-methylthiourea Traditional Name: 1-[(Z)-[3-(3,4-dimethoxyphenyl)-1-phenyl-pyrazol-4-yl]methyleneamino]-3-methyl-thiourea Formula: C20H21N5O2S MolecularWeight: 395.47804

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CNC(=S)NN=CC1=CN(N=C1C2=CC(=C(C=C2)OC)OC)C3=CC=CC=C3

Isomeric SMILES

CNC(=S)N/N=C\C1=CN(N=C1C2=CC(=C(C=C2)OC)OC)C3=CC=CC=C3

InChI

InChI=1S/C20H21N5O2S/c1-21-20(28)23-22-12-15-13-25(16-7-5-4-6-8-16)24-19(15)14-9-10-17(26-2)18(11-14)27-3/h4-13H,1-3H3,(H2,21,23,28)/b22-12-