1-[4-(4-methoxyphenyl)-6-(6-oxidanylidenecyclohexa-2,4-dien-1-ylidene)-1H-pyrimidin-2-yl]thiourea

Systemtic Name: 1-[4-(4-methoxyphenyl)-6-(6-oxidanylidenecyclohexa-2,4-dien-1-ylidene)-1H-pyrimidin-2-yl]thiourea Openeye Name: [4-(4-methoxyphenyl)-6-(6-oxocyclohexa-2,4-dien-1-ylidene)-1H-pyrimidin-2-yl]thiourea CAS Name: [4-(4-methoxyphenyl)-6-(6-oxo-1-cyclohexa-2,4-dienylidene)-1H-pyrimidin-2-yl]thiourea IUPAC Name: [4-(4-methoxyphenyl)-6-(6-oxocyclohexa-2,4-dien-1-ylidene)-1H-pyrimidin-2-yl]thiourea Traditional Name: [6-(6-ketocyclohexa-2,4-dien-1-ylidene)-4-(4-methoxyphenyl)-1H-pyrimidin-2-yl]thiourea Formula: C18H16N4O2S MolecularWeight: 352.41024

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C2=CC(=C3C=CC=CC3=O)NC(=N2)NC(=S)N

Isomeric SMILES

COC1=CC=C(C=C1)C2=CC(=C3C=CC=CC3=O)NC(=N2)NC(=S)N

InChI

InChI=1S/C18H16N4O2S/c1-24-12-8-6-11(7-9-12)14-10-15(13-4-2-3-5-16(13)23)21-18(20-14)22-17(19)25/h2-10H,1H3,(H4,19,20,21,22,25)