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

Systemtic Name: 1-(3-methoxyphenyl)-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-(3-methoxyphenyl)thiourea CAS Name: 1-(3-methoxyphenyl)-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-(3-methoxyphenyl)thiourea Traditional Name: 1-[(E)-[1-benzyl-3-(3-pyridyl)pyrazol-4-yl]methyleneamino]-3-(3-methoxyphenyl)thiourea Formula: C24H22N6OS MolecularWeight: 442.53608

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1)NC(=S)NN=CC2=CN(N=C2C3=CN=CC=C3)CC4=CC=CC=C4

Isomeric SMILES

COC1=CC=CC(=C1)NC(=S)N/N=C/C2=CN(N=C2C3=CN=CC=C3)CC4=CC=CC=C4

InChI

InChI=1S/C24H22N6OS/c1-31-22-11-5-10-21(13-22)27-24(32)28-26-15-20-17-30(16-18-7-3-2-4-8-18)29-23(20)19-9-6-12-25-14-19/h2-15,17H,16H2,1H3,(H2,27,28,32)/b26-15+