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

Systemtic Name: 4-oxidanylidene-N-[(1-phenylpyrrolidin-3-yl)methyl]-3-prop-2-enyl-2-sulfanylidene-1H-quinazoline-7-carboxamide Openeye Name: 3-allyl-4-oxo-N-[(1-phenylpyrrolidin-3-yl)methyl]-2-thioxo-1H-quinazoline-7-carboxamide CAS Name: 4-oxo-N-[(1-phenyl-3-pyrrolidinyl)methyl]-3-prop-2-enyl-2-sulfanylidene-1H-quinazoline-7-carboxamide IUPAC Name: 4-oxo-N-[(1-phenylpyrrolidin-3-yl)methyl]-3-prop-2-enyl-2-sulfanylidene-1H-quinazoline-7-carboxamide Traditional Name: 3-allyl-4-keto-N-[(1-phenylpyrrolidin-3-yl)methyl]-2-thioxo-1H-quinazoline-7-carboxamide Formula: C23H24N4O2S MolecularWeight: 420.52726

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C=CCN1C(=O)C2=C(C=C(C=C2)C(=O)NCC3CCN(C3)C4=CC=CC=C4)NC1=S

Isomeric SMILES

C=CCN1C(=O)C2=C(C=C(C=C2)C(=O)NCC3CCN(C3)C4=CC=CC=C4)NC1=S

InChI

InChI=1S/C23H24N4O2S/c1-2-11-27-22(29)19-9-8-17(13-20(19)25-23(27)30)21(28)24-14-16-10-12-26(15-16)18-6-4-3-5-7-18/h2-9,13,16H,1,10-12,14-15H2,(H,24,28)(H,25,30)