3-(furan-2-ylmethyl)-7-[(4-methoxyphenyl)carbamoyl]-2-sulfanylidene-quinazolin-4-olate

Systemtic Name: 3-(furan-2-ylmethyl)-7-[(4-methoxyphenyl)carbamoyl]-2-sulfanylidene-quinazolin-4-olate Openeye Name: 3-(2-furylmethyl)-7-[(4-methoxyphenyl)carbamoyl]-2-thioxo-quinazolin-4-olate CAS Name: 3-(2-furanylmethyl)-7-[(4-methoxyanilino)-oxomethyl]-2-sulfanylidene-4-quinazolinolate IUPAC Name: 3-(furan-2-ylmethyl)-7-[(4-methoxyphenyl)carbamoyl]-2-sulfanylidenequinazolin-4-olate Traditional Name: 3-(2-furfuryl)-7-[(4-methoxyphenyl)carbamoyl]-2-thioxo-quinazolin-4-olate Formula: C21H16N3O4S- MolecularWeight: 406.43444

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)NC(=O)C2=CC3=NC(=S)N(C(=C3C=C2)[O-])CC4=CC=CO4

Isomeric SMILES

COC1=CC=C(C=C1)NC(=O)C2=CC3=NC(=S)N(C(=C3C=C2)[O-])CC4=CC=CO4

InChI

InChI=1S/C21H17N3O4S/c1-27-15-7-5-14(6-8-15)22-19(25)13-4-9-17-18(11-13)23-21(29)24(20(17)26)12-16-3-2-10-28-16/h2-11,26H,12H2,1H3,(H,22,25)/p-1