N-[3-chloranyl-4-(2-oxidanylidenepyrrolidin-1-yl)phenyl]-3-(3-methoxypropyl)-4-oxidanylidene-2-sulfanylidene-1H-quinazoline-7-carboxamide

Systemtic Name: N-[3-chloranyl-4-(2-oxidanylidenepyrrolidin-1-yl)phenyl]-3-(3-methoxypropyl)-4-oxidanylidene-2-sulfanylidene-1H-quinazoline-7-carboxamide Openeye Name: N-[3-chloro-4-(2-oxopyrrolidin-1-yl)phenyl]-3-(3-methoxypropyl)-4-oxo-2-thioxo-1H-quinazoline-7-carboxamide CAS Name: N-[3-chloro-4-(2-oxo-1-pyrrolidinyl)phenyl]-3-(3-methoxypropyl)-4-oxo-2-sulfanylidene-1H-quinazoline-7-carboxamide IUPAC Name: N-[3-chloro-4-(2-oxopyrrolidin-1-yl)phenyl]-3-(3-methoxypropyl)-4-oxo-2-sulfanylidene-1H-quinazoline-7-carboxamide Traditional Name: N-[3-chloro-4-(2-ketopyrrolidino)phenyl]-4-keto-3-(3-methoxypropyl)-2-thioxo-1H-quinazoline-7-carboxamide Formula: C23H23ClN4O4S MolecularWeight: 486.97112

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Descriptors Computed from Structure

Canonical SMILES:

COCCCN1C(=O)C2=C(C=C(C=C2)C(=O)NC3=CC(=C(C=C3)N4CCCC4=O)Cl)NC1=S

Isomeric SMILES

COCCCN1C(=O)C2=C(C=C(C=C2)C(=O)NC3=CC(=C(C=C3)N4CCCC4=O)Cl)NC1=S

InChI

InChI=1S/C23H23ClN4O4S/c1-32-11-3-10-28-22(31)16-7-5-14(12-18(16)26-23(28)33)21(30)25-15-6-8-19(17(24)13-15)27-9-2-4-20(27)29/h5-8,12-13H,2-4,9-11H2,1H3,(H,25,30)(H,26,33)