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

Systemtic Name: 4-oxidanylidene-N-[(1-phenylcyclobutyl)methyl]-3-prop-2-enyl-2-sulfanylidene-1H-quinazoline-7-carboxamide Openeye Name: 3-allyl-4-oxo-N-[(1-phenylcyclobutyl)methyl]-2-thioxo-1H-quinazoline-7-carboxamide CAS Name: 4-oxo-N-[(1-phenylcyclobutyl)methyl]-3-prop-2-enyl-2-sulfanylidene-1H-quinazoline-7-carboxamide IUPAC Name: 4-oxo-N-[(1-phenylcyclobutyl)methyl]-3-prop-2-enyl-2-sulfanylidene-1H-quinazoline-7-carboxamide Traditional Name: 3-allyl-4-keto-N-[(1-phenylcyclobutyl)methyl]-2-thioxo-1H-quinazoline-7-carboxamide Formula: C23H23N3O2S MolecularWeight: 405.51262

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Descriptors Computed from Structure

Canonical SMILES:

C=CCN1C(=O)C2=C(C=C(C=C2)C(=O)NCC3(CCC3)C4=CC=CC=C4)NC1=S

Isomeric SMILES

C=CCN1C(=O)C2=C(C=C(C=C2)C(=O)NCC3(CCC3)C4=CC=CC=C4)NC1=S

InChI

InChI=1S/C23H23N3O2S/c1-2-13-26-21(28)18-10-9-16(14-19(18)25-22(26)29)20(27)24-15-23(11-6-12-23)17-7-4-3-5-8-17/h2-5,7-10,14H,1,6,11-13,15H2,(H,24,27)(H,25,29)