1-[(Z)-[2-(3-oxidanylidene-1H-2-benzofuran-1-yl)-1-pyridin-3-yl-ethylidene]amino]thiourea

Systemtic Name: 1-[(Z)-[2-(3-oxidanylidene-1H-2-benzofuran-1-yl)-1-pyridin-3-yl-ethylidene]amino]thiourea Openeye Name: [(Z)-[2-(3-oxo-1H-isobenzofuran-1-yl)-1-(3-pyridyl)ethylidene]amino]thiourea CAS Name: [(Z)-[2-(3-oxo-1H-isobenzofuran-1-yl)-1-(3-pyridinyl)ethylidene]amino]thiourea IUPAC Name: [(Z)-[2-(3-oxo-1H-2-benzofuran-1-yl)-1-pyridin-3-ylethylidene]amino]thiourea Traditional Name: [(Z)-[2-phthalidyl-1-(3-pyridyl)ethylidene]amino]thiourea Formula: C16H14N4O2S MolecularWeight: 326.37296

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(OC2=O)CC(=NNC(=S)N)C3=CN=CC=C3

Isomeric SMILES

C1=CC=C2C(=C1)C(OC2=O)C/C(=N/NC(=S)N)/C3=CN=CC=C3

InChI

InChI=1S/C16H14N4O2S/c17-16(23)20-19-13(10-4-3-7-18-9-10)8-14-11-5-1-2-6-12(11)15(21)22-14/h1-7,9,14H,8H2,(H3,17,20,23)/b19-13-