N-(2-hydroxyethyl)-3-(2-methoxyethyl)-4-oxidanylidene-N-(phenylmethyl)-2-sulfanylidene-1H-quinazoline-7-carboxamide

Systemtic Name: N-(2-hydroxyethyl)-3-(2-methoxyethyl)-4-oxidanylidene-N-(phenylmethyl)-2-sulfanylidene-1H-quinazoline-7-carboxamide Openeye Name: N-benzyl-N-(2-hydroxyethyl)-3-(2-methoxyethyl)-4-oxo-2-thioxo-1H-quinazoline-7-carboxamide CAS Name: N-(2-hydroxyethyl)-3-(2-methoxyethyl)-4-oxo-N-(phenylmethyl)-2-sulfanylidene-1H-quinazoline-7-carboxamide IUPAC Name: N-benzyl-N-(2-hydroxyethyl)-3-(2-methoxyethyl)-4-oxo-2-sulfanylidene-1H-quinazoline-7-carboxamide Traditional Name: N-benzyl-N-(2-hydroxyethyl)-4-keto-3-(2-methoxyethyl)-2-thioxo-1H-quinazoline-7-carboxamide Formula: C21H23N3O4S MolecularWeight: 413.49002

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Descriptors Computed from Structure

Canonical SMILES:

COCCN1C(=O)C2=C(C=C(C=C2)C(=O)N(CCO)CC3=CC=CC=C3)NC1=S

Isomeric SMILES

COCCN1C(=O)C2=C(C=C(C=C2)C(=O)N(CCO)CC3=CC=CC=C3)NC1=S

InChI

InChI=1S/C21H23N3O4S/c1-28-12-10-24-20(27)17-8-7-16(13-18(17)22-21(24)29)19(26)23(9-11-25)14-15-5-3-2-4-6-15/h2-8,13,25H,9-12,14H2,1H3,(H,22,29)