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

Systemtic Name: 4-oxidanylidene-N-[[4-(phenylmethoxymethyl)phenyl]methyl]-3-prop-2-enyl-2-sulfanylidene-1H-quinazoline-7-carboxamide Openeye Name: 3-allyl-N-[[4-(benzyloxymethyl)phenyl]methyl]-4-oxo-2-thioxo-1H-quinazoline-7-carboxamide CAS Name: 4-oxo-N-[[4-(phenylmethoxymethyl)phenyl]methyl]-3-prop-2-enyl-2-sulfanylidene-1H-quinazoline-7-carboxamide IUPAC Name: 4-oxo-N-[[4-(phenylmethoxymethyl)phenyl]methyl]-3-prop-2-enyl-2-sulfanylidene-1H-quinazoline-7-carboxamide Traditional Name: 3-allyl-N-[4-(benzoxymethyl)benzyl]-4-keto-2-thioxo-1H-quinazoline-7-carboxamide Formula: C27H25N3O3S MolecularWeight: 471.5707

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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)COCC4=CC=CC=C4)NC1=S

Isomeric SMILES

C=CCN1C(=O)C2=C(C=C(C=C2)C(=O)NCC3=CC=C(C=C3)COCC4=CC=CC=C4)NC1=S

InChI

InChI=1S/C27H25N3O3S/c1-2-14-30-26(32)23-13-12-22(15-24(23)29-27(30)34)25(31)28-16-19-8-10-21(11-9-19)18-33-17-20-6-4-3-5-7-20/h2-13,15H,1,14,16-18H2,(H,28,31)(H,29,34)