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

Systemtic Name: N-[3-chloranyl-4-(2-oxidanylidenepyrrolidin-1-yl)phenyl]-3-methyl-4-oxidanylidene-2-sulfanylidene-1H-quinazoline-7-carboxamide Openeye Name: N-[3-chloro-4-(2-oxopyrrolidin-1-yl)phenyl]-3-methyl-4-oxo-2-thioxo-1H-quinazoline-7-carboxamide CAS Name: N-[3-chloro-4-(2-oxo-1-pyrrolidinyl)phenyl]-3-methyl-4-oxo-2-sulfanylidene-1H-quinazoline-7-carboxamide IUPAC Name: N-[3-chloro-4-(2-oxopyrrolidin-1-yl)phenyl]-3-methyl-4-oxo-2-sulfanylidene-1H-quinazoline-7-carboxamide Traditional Name: N-[3-chloro-4-(2-ketopyrrolidino)phenyl]-4-keto-3-methyl-2-thioxo-1H-quinazoline-7-carboxamide Formula: C20H17ClN4O3S MolecularWeight: 428.89198

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=O)C2=C(C=C(C=C2)C(=O)NC3=CC(=C(C=C3)N4CCCC4=O)Cl)NC1=S

Isomeric SMILES

CN1C(=O)C2=C(C=C(C=C2)C(=O)NC3=CC(=C(C=C3)N4CCCC4=O)Cl)NC1=S

InChI

InChI=1S/C20H17ClN4O3S/c1-24-19(28)13-6-4-11(9-15(13)23-20(24)29)18(27)22-12-5-7-16(14(21)10-12)25-8-2-3-17(25)26/h4-7,9-10H,2-3,8H2,1H3,(H,22,27)(H,23,29)