1-[(E)-(5-ethoxy-3-methyl-1-phenyl-pyrazol-4-yl)methylideneamino]-3-phenyl-thiourea

Systemtic Name: 1-[(E)-(5-ethoxy-3-methyl-1-phenyl-pyrazol-4-yl)methylideneamino]-3-phenyl-thiourea Openeye Name: 1-[(E)-(5-ethoxy-3-methyl-1-phenyl-pyrazol-4-yl)methyleneamino]-3-phenyl-thiourea CAS Name: 1-[(E)-(5-ethoxy-3-methyl-1-phenyl-4-pyrazolyl)methylideneamino]-3-phenylthiourea IUPAC Name: 1-[(E)-(5-ethoxy-3-methyl-1-phenylpyrazol-4-yl)methylideneamino]-3-phenylthiourea Traditional Name: 1-[(E)-(5-ethoxy-3-methyl-1-phenyl-pyrazol-4-yl)methyleneamino]-3-phenyl-thiourea Formula: C20H21N5OS MolecularWeight: 379.47864

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C(=NN1C2=CC=CC=C2)C)C=NNC(=S)NC3=CC=CC=C3

Isomeric SMILES

CCOC1=C(C(=NN1C2=CC=CC=C2)C)/C=N/NC(=S)NC3=CC=CC=C3

InChI

InChI=1S/C20H21N5OS/c1-3-26-19-18(15(2)24-25(19)17-12-8-5-9-13-17)14-21-23-20(27)22-16-10-6-4-7-11-16/h4-14H,3H2,1-2H3,(H2,22,23,27)/b21-14+