2-[2-[(4-cyclopropyl-3-ethoxycarbonyl-thiophen-2-yl)amino]-2-oxidanylidene-ethyl]sulfanylquinazolin-4-olate

Systemtic Name: 2-[2-[(4-cyclopropyl-3-ethoxycarbonyl-thiophen-2-yl)amino]-2-oxidanylidene-ethyl]sulfanylquinazolin-4-olate Openeye Name: 2-[2-[(4-cyclopropyl-3-ethoxycarbonyl-2-thienyl)amino]-2-oxo-ethyl]sulfanylquinazolin-4-olate CAS Name: 2-[[2-[(4-cyclopropyl-3-ethoxycarbonyl-2-thiophenyl)amino]-2-oxoethyl]thio]-4-quinazolinolate IUPAC Name: 2-[2-[(4-cyclopropyl-3-ethoxycarbonylthiophen-2-yl)amino]-2-oxoethyl]sulfanylquinazolin-4-olate Traditional Name: 2-[[2-[(3-carbethoxy-4-cyclopropyl-2-thienyl)amino]-2-keto-ethyl]thio]quinazolin-4-olate Formula: C20H18N3O4S2- MolecularWeight: 428.50462

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(SC=C1C2CC2)NC(=O)CSC3=NC4=CC=CC=C4C(=N3)[O-]

Isomeric SMILES

CCOC(=O)C1=C(SC=C1C2CC2)NC(=O)CSC3=NC4=CC=CC=C4C(=N3)[O-]

InChI

InChI=1S/C20H19N3O4S2/c1-2-27-19(26)16-13(11-7-8-11)9-28-18(16)22-15(24)10-29-20-21-14-6-4-3-5-12(14)17(25)23-20/h3-6,9,11H,2,7-8,10H2,1H3,(H,22,24)(H,21,23,25)/p-1