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

Systemtic Name: 1-(phenylmethyl)-3-[(1-phenyl-3-thiophen-2-yl-pyrazol-4-yl)methylideneamino]thiourea Openeye Name: 1-benzyl-3-[[1-phenyl-3-(2-thienyl)pyrazol-4-yl]methyleneamino]thiourea CAS Name: 1-(phenylmethyl)-3-[(1-phenyl-3-thiophen-2-yl-4-pyrazolyl)methylideneamino]thiourea IUPAC Name: 1-benzyl-3-[(1-phenyl-3-thiophen-2-ylpyrazol-4-yl)methylideneamino]thiourea Traditional Name: 1-benzyl-3-[[1-phenyl-3-(2-thienyl)pyrazol-4-yl]methyleneamino]thiourea Formula: C22H19N5S2 MolecularWeight: 417.54976

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CNC(=S)NN=CC2=CN(N=C2C3=CC=CS3)C4=CC=CC=C4

Isomeric SMILES

C1=CC=C(C=C1)CNC(=S)NN=CC2=CN(N=C2C3=CC=CS3)C4=CC=CC=C4

InChI

InChI=1S/C22H19N5S2/c28-22(23-14-17-8-3-1-4-9-17)25-24-15-18-16-27(19-10-5-2-6-11-19)26-21(18)20-12-7-13-29-20/h1-13,15-16H,14H2,(H2,23,25,28)