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

Systemtic Name: 4-oxidanylidene-N-[[4-(2-oxidanylidenepyrrolidin-1-yl)phenyl]methyl]-3-prop-2-enyl-2-sulfanylidene-1H-quinazoline-7-carboxamide Openeye Name: 3-allyl-4-oxo-N-[[4-(2-oxopyrrolidin-1-yl)phenyl]methyl]-2-thioxo-1H-quinazoline-7-carboxamide CAS Name: 4-oxo-N-[[4-(2-oxo-1-pyrrolidinyl)phenyl]methyl]-3-prop-2-enyl-2-sulfanylidene-1H-quinazoline-7-carboxamide IUPAC Name: 4-oxo-N-[[4-(2-oxopyrrolidin-1-yl)phenyl]methyl]-3-prop-2-enyl-2-sulfanylidene-1H-quinazoline-7-carboxamide Traditional Name: 3-allyl-4-keto-N-[4-(2-ketopyrrolidino)benzyl]-2-thioxo-1H-quinazoline-7-carboxamide Formula: C23H22N4O3S MolecularWeight: 434.51078

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Descriptors Computed from Structure

Canonical SMILES:

C=CCN1C(=O)C2=C(C=C(C=C2)C(=O)NCC3=CC=C(C=C3)N4CCCC4=O)NC1=S

Isomeric SMILES

C=CCN1C(=O)C2=C(C=C(C=C2)C(=O)NCC3=CC=C(C=C3)N4CCCC4=O)NC1=S

InChI

InChI=1S/C23H22N4O3S/c1-2-11-27-22(30)18-10-7-16(13-19(18)25-23(27)31)21(29)24-14-15-5-8-17(9-6-15)26-12-3-4-20(26)28/h2,5-10,13H,1,3-4,11-12,14H2,(H,24,29)(H,25,31)