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

Systemtic Name: 1-[(Z)-[3-(1-benzofuran-2-yl)-1-phenyl-pyrazol-4-yl]methylideneamino]-3-propan-2-yl-thiourea Openeye Name: 1-[(Z)-[3-(benzofuran-2-yl)-1-phenyl-pyrazol-4-yl]methyleneamino]-3-isopropyl-thiourea CAS Name: 1-[(Z)-[3-(2-benzofuranyl)-1-phenyl-4-pyrazolyl]methylideneamino]-3-propan-2-ylthiourea IUPAC Name: 1-[(Z)-[3-(1-benzofuran-2-yl)-1-phenylpyrazol-4-yl]methylideneamino]-3-propan-2-ylthiourea Traditional Name: 1-[(Z)-[3-(benzofuran-2-yl)-1-phenyl-pyrazol-4-yl]methyleneamino]-3-isopropyl-thiourea Formula: C22H21N5OS MolecularWeight: 403.50004

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H21N5OS/c1-15(2)24-22(29)25-23-13-17-14-27(18-9-4-3-5-10-18)26-21(17)20-12-16-8-6-7-11-19(16)28-20/h3-15H,1-2H3,(H2,24,25,29)/b23-13-