3-[(2-methoxyphenyl)methyl]-4-oxidanylidene-2-sulfanylidene-N-(thiophen-2-ylmethyl)-1H-quinazoline-7-carboxamide

Systemtic Name: 3-[(2-methoxyphenyl)methyl]-4-oxidanylidene-2-sulfanylidene-N-(thiophen-2-ylmethyl)-1H-quinazoline-7-carboxamide Openeye Name: 3-[(2-methoxyphenyl)methyl]-4-oxo-N-(2-thienylmethyl)-2-thioxo-1H-quinazoline-7-carboxamide CAS Name: 3-[(2-methoxyphenyl)methyl]-4-oxo-2-sulfanylidene-N-(thiophen-2-ylmethyl)-1H-quinazoline-7-carboxamide IUPAC Name: 3-[(2-methoxyphenyl)methyl]-4-oxo-2-sulfanylidene-N-(thiophen-2-ylmethyl)-1H-quinazoline-7-carboxamide Traditional Name: 4-keto-3-o-anisyl-N-(2-thenyl)-2-thioxo-1H-quinazoline-7-carboxamide Formula: C22H19N3O3S2 MolecularWeight: 437.53456

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC=C1CN2C(=O)C3=C(C=C(C=C3)C(=O)NCC4=CC=CS4)NC2=S

Isomeric SMILES

COC1=CC=CC=C1CN2C(=O)C3=C(C=C(C=C3)C(=O)NCC4=CC=CS4)NC2=S

InChI

InChI=1S/C22H19N3O3S2/c1-28-19-7-3-2-5-15(19)13-25-21(27)17-9-8-14(11-18(17)24-22(25)29)20(26)23-12-16-6-4-10-30-16/h2-11H,12-13H2,1H3,(H,23,26)(H,24,29)