N-[(3,4-dimethoxyphenyl)methyl]-3-ethyl-4-oxidanylidene-2-sulfanylidene-1H-quinazoline-7-carboxamide

Systemtic Name: N-[(3,4-dimethoxyphenyl)methyl]-3-ethyl-4-oxidanylidene-2-sulfanylidene-1H-quinazoline-7-carboxamide Openeye Name: N-[(3,4-dimethoxyphenyl)methyl]-3-ethyl-4-oxo-2-thioxo-1H-quinazoline-7-carboxamide CAS Name: N-[(3,4-dimethoxyphenyl)methyl]-3-ethyl-4-oxo-2-sulfanylidene-1H-quinazoline-7-carboxamide IUPAC Name: N-[(3,4-dimethoxyphenyl)methyl]-3-ethyl-4-oxo-2-sulfanylidene-1H-quinazoline-7-carboxamide Traditional Name: 3-ethyl-4-keto-2-thioxo-N-veratryl-1H-quinazoline-7-carboxamide Formula: C20H21N3O4S MolecularWeight: 399.46344

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=O)C2=C(C=C(C=C2)C(=O)NCC3=CC(=C(C=C3)OC)OC)NC1=S

Isomeric SMILES

CCN1C(=O)C2=C(C=C(C=C2)C(=O)NCC3=CC(=C(C=C3)OC)OC)NC1=S

InChI

InChI=1S/C20H21N3O4S/c1-4-23-19(25)14-7-6-13(10-15(14)22-20(23)28)18(24)21-11-12-5-8-16(26-2)17(9-12)27-3/h5-10H,4,11H2,1-3H3,(H,21,24)(H,22,28)