1-azanyl-3-[[2-(3-oxidanylidene-1H-2-benzofuran-1-yl)-1-(6-oxidanylidenecyclohexa-2,4-dien-1-ylidene)ethyl]amino]thiourea

Systemtic Name: 1-azanyl-3-[[2-(3-oxidanylidene-1H-2-benzofuran-1-yl)-1-(6-oxidanylidenecyclohexa-2,4-dien-1-ylidene)ethyl]amino]thiourea Openeye Name: 1-amino-3-[[1-(6-oxocyclohexa-2,4-dien-1-ylidene)-2-(3-oxo-1H-isobenzofuran-1-yl)ethyl]amino]thiourea CAS Name: 1-amino-3-[[1-(6-oxo-1-cyclohexa-2,4-dienylidene)-2-(3-oxo-1H-isobenzofuran-1-yl)ethyl]amino]thiourea IUPAC Name: 1-amino-3-[[2-(3-oxo-1H-2-benzofuran-1-yl)-1-(6-oxocyclohexa-2,4-dien-1-ylidene)ethyl]amino]thiourea Traditional Name: 1-amino-3-[[1-(6-ketocyclohexa-2,4-dien-1-ylidene)-2-phthalidyl-ethyl]amino]thiourea Formula: C17H16N4O3S MolecularWeight: 356.39894

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(OC2=O)CC(=C3C=CC=CC3=O)NNC(=S)NN

Isomeric SMILES

C1=CC=C2C(=C1)C(OC2=O)CC(=C3C=CC=CC3=O)NNC(=S)NN

InChI

InChI=1S/C17H16N4O3S/c18-19-17(25)21-20-13(12-7-3-4-8-14(12)22)9-15-10-5-1-2-6-11(10)16(23)24-15/h1-8,15,20H,9,18H2,(H2,19,21,25)