N,N-diethyl-4-oxidanylidene-3-(phenylmethyl)-2-sulfanylidene-1H-quinazoline-7-carboxamide

Systemtic Name: N,N-diethyl-4-oxidanylidene-3-(phenylmethyl)-2-sulfanylidene-1H-quinazoline-7-carboxamide Openeye Name: 3-benzyl-N,N-diethyl-4-oxo-2-thioxo-1H-quinazoline-7-carboxamide CAS Name: N,N-diethyl-4-oxo-3-(phenylmethyl)-2-sulfanylidene-1H-quinazoline-7-carboxamide IUPAC Name: 3-benzyl-N,N-diethyl-4-oxo-2-sulfanylidene-1H-quinazoline-7-carboxamide Traditional Name: 3-benzyl-N,N-diethyl-4-keto-2-thioxo-1H-quinazoline-7-carboxamide Formula: C20H21N3O2S MolecularWeight: 367.46464

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)C(=O)C1=CC2=C(C=C1)C(=O)N(C(=S)N2)CC3=CC=CC=C3

Isomeric SMILES

CCN(CC)C(=O)C1=CC2=C(C=C1)C(=O)N(C(=S)N2)CC3=CC=CC=C3

InChI

InChI=1S/C20H21N3O2S/c1-3-22(4-2)18(24)15-10-11-16-17(12-15)21-20(26)23(19(16)25)13-14-8-6-5-7-9-14/h5-12H,3-4,13H2,1-2H3,(H,21,26)