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

Systemtic Name: 1-[(Z)-[3-(1-benzofuran-2-yl)-1-phenyl-pyrazol-4-yl]methylideneamino]-3-(2-methoxyethyl)thiourea Openeye Name: 1-[(Z)-[3-(benzofuran-2-yl)-1-phenyl-pyrazol-4-yl]methyleneamino]-3-(2-methoxyethyl)thiourea CAS Name: 1-[(Z)-[3-(2-benzofuranyl)-1-phenyl-4-pyrazolyl]methylideneamino]-3-(2-methoxyethyl)thiourea IUPAC Name: 1-[(Z)-[3-(1-benzofuran-2-yl)-1-phenylpyrazol-4-yl]methylideneamino]-3-(2-methoxyethyl)thiourea Traditional Name: 1-[(Z)-[3-(benzofuran-2-yl)-1-phenyl-pyrazol-4-yl]methyleneamino]-3-(2-methoxyethyl)thiourea Formula: C22H21N5O2S MolecularWeight: 419.49944

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Descriptors Computed from Structure

Canonical SMILES:

COCCNC(=S)NN=CC1=CN(N=C1C2=CC3=CC=CC=C3O2)C4=CC=CC=C4

Isomeric SMILES

COCCNC(=S)N/N=C\C1=CN(N=C1C2=CC3=CC=CC=C3O2)C4=CC=CC=C4

InChI

InChI=1S/C22H21N5O2S/c1-28-12-11-23-22(30)25-24-14-17-15-27(18-8-3-2-4-9-18)26-21(17)20-13-16-7-5-6-10-19(16)29-20/h2-10,13-15H,11-12H2,1H3,(H2,23,25,30)/b24-14-