1-(2-methoxyethyl)-3-[(Z)-[1-(phenylmethyl)-3-pyridin-3-yl-pyrazol-4-yl]methylideneamino]thiourea

Systemtic Name: 1-(2-methoxyethyl)-3-[(Z)-[1-(phenylmethyl)-3-pyridin-3-yl-pyrazol-4-yl]methylideneamino]thiourea Openeye Name: 1-[(Z)-[1-benzyl-3-(3-pyridyl)pyrazol-4-yl]methyleneamino]-3-(2-methoxyethyl)thiourea CAS Name: 1-(2-methoxyethyl)-3-[(Z)-[1-(phenylmethyl)-3-(3-pyridinyl)-4-pyrazolyl]methylideneamino]thiourea IUPAC Name: 1-[(Z)-(1-benzyl-3-pyridin-3-ylpyrazol-4-yl)methylideneamino]-3-(2-methoxyethyl)thiourea Traditional Name: 1-[(Z)-[1-benzyl-3-(3-pyridyl)pyrazol-4-yl]methyleneamino]-3-(2-methoxyethyl)thiourea Formula: C20H22N6OS MolecularWeight: 394.49328

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Descriptors Computed from Structure

Canonical SMILES:

COCCNC(=S)NN=CC1=CN(N=C1C2=CN=CC=C2)CC3=CC=CC=C3

Isomeric SMILES

COCCNC(=S)N/N=C\C1=CN(N=C1C2=CN=CC=C2)CC3=CC=CC=C3

InChI

InChI=1S/C20H22N6OS/c1-27-11-10-22-20(28)24-23-13-18-15-26(14-16-6-3-2-4-7-16)25-19(18)17-8-5-9-21-12-17/h2-9,12-13,15H,10-11,14H2,1H3,(H2,22,24,28)/b23-13-