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

Systemtic Name: 1-(2-methoxyethyl)-3-[(Z)-[3-phenyl-1-(phenylmethyl)pyrazol-4-yl]methylideneamino]thiourea Openeye Name: 1-[(Z)-(1-benzyl-3-phenyl-pyrazol-4-yl)methyleneamino]-3-(2-methoxyethyl)thiourea CAS Name: 1-(2-methoxyethyl)-3-[(Z)-[3-phenyl-1-(phenylmethyl)-4-pyrazolyl]methylideneamino]thiourea IUPAC Name: 1-[(Z)-(1-benzyl-3-phenylpyrazol-4-yl)methylideneamino]-3-(2-methoxyethyl)thiourea Traditional Name: 1-[(Z)-(1-benzyl-3-phenyl-pyrazol-4-yl)methyleneamino]-3-(2-methoxyethyl)thiourea Formula: C21H23N5OS MolecularWeight: 393.50522

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H23N5OS/c1-27-13-12-22-21(28)24-23-14-19-16-26(15-17-8-4-2-5-9-17)25-20(19)18-10-6-3-7-11-18/h2-11,14,16H,12-13,15H2,1H3,(H2,22,24,28)/b23-14-