ethyl [(4Z)-4-[4-(4-methoxynaphthalen-1-yl)-5-sulfanyl-1,2-dihydropyrazol-3-ylidene]-3-oxidanylidene-6-propan-2-yl-cyclohexa-1,5-dien-1-yl] carbonate

Systemtic Name: ethyl [(4Z)-4-[4-(4-methoxynaphthalen-1-yl)-5-sulfanyl-1,2-dihydropyrazol-3-ylidene]-3-oxidanylidene-6-propan-2-yl-cyclohexa-1,5-dien-1-yl] carbonate Openeye Name: ethyl [(4Z)-6-isopropyl-4-[4-(4-methoxy-1-naphthyl)-5-sulfanyl-1,2-dihydropyrazol-3-ylidene]-3-oxo-cyclohexa-1,5-dien-1-yl] carbonate CAS Name: carbonic acid ethyl [(4Z)-4-[5-mercapto-4-(4-methoxy-1-naphthalenyl)-1,2-dihydropyrazol-3-ylidene]-3-oxo-6-propan-2-yl-1-cyclohexa-1,5-dienyl] ester IUPAC Name: ethyl [(4Z)-4-[4-(4-methoxynaphthalen-1-yl)-5-sulfanyl-1,2-dihydropyrazol-3-ylidene]-3-oxo-6-propan-2-ylcyclohexa-1,5-dien-1-yl] carbonate Traditional Name: carbonic acid ethyl [(4Z)-6-isopropyl-3-keto-4-[5-mercapto-4-(4-methoxy-1-naphthyl)-3-pyrazolin-3-ylidene]cyclohexa-1,5-dien-1-yl] ester Formula: C26H26N2O5S MolecularWeight: 478.56004

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)OC1=CC(=O)C(=C2C(=C(NN2)S)C3=CC=C(C4=CC=CC=C43)OC)C=C1C(C)C

Isomeric SMILES

CCOC(=O)OC1=CC(=O)/C(=C\2/C(=C(NN2)S)C3=CC=C(C4=CC=CC=C43)OC)/C=C1C(C)C

InChI

InChI=1S/C26H26N2O5S/c1-5-32-26(30)33-22-13-20(29)19(12-18(22)14(2)3)24-23(25(34)28-27-24)17-10-11-21(31-4)16-9-7-6-8-15(16)17/h6-14,27-28,34H,5H2,1-4H3/b24-19-