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

Systemtic Name: 4-oxidanylidene-N-[(1-phenylcyclobutyl)methyl]-2-sulfanylidene-1H-quinazoline-7-carboxamide Openeye Name: 4-oxo-N-[(1-phenylcyclobutyl)methyl]-2-thioxo-1H-quinazoline-7-carboxamide CAS Name: 4-oxo-N-[(1-phenylcyclobutyl)methyl]-2-sulfanylidene-1H-quinazoline-7-carboxamide IUPAC Name: 4-oxo-N-[(1-phenylcyclobutyl)methyl]-2-sulfanylidene-1H-quinazoline-7-carboxamide Traditional Name: 4-keto-N-[(1-phenylcyclobutyl)methyl]-2-thioxo-1H-quinazoline-7-carboxamide Formula: C20H19N3O2S MolecularWeight: 365.44876

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(C1)(CNC(=O)C2=CC3=C(C=C2)C(=O)NC(=S)N3)C4=CC=CC=C4

Isomeric SMILES

C1CC(C1)(CNC(=O)C2=CC3=C(C=C2)C(=O)NC(=S)N3)C4=CC=CC=C4

InChI

InChI=1S/C20H19N3O2S/c24-17(13-7-8-15-16(11-13)22-19(26)23-18(15)25)21-12-20(9-4-10-20)14-5-2-1-3-6-14/h1-3,5-8,11H,4,9-10,12H2,(H,21,24)(H2,22,23,25,26)