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

Systemtic Name: 4-oxidanylidene-N-[(1S)-1-phenylethyl]-3-prop-2-enyl-2-sulfanylidene-1H-quinazoline-7-carboxamide Openeye Name: 3-allyl-4-oxo-N-[(1S)-1-phenylethyl]-2-thioxo-1H-quinazoline-7-carboxamide CAS Name: 4-oxo-N-[(1S)-1-phenylethyl]-3-prop-2-enyl-2-sulfanylidene-1H-quinazoline-7-carboxamide IUPAC Name: 4-oxo-N-[(1S)-1-phenylethyl]-3-prop-2-enyl-2-sulfanylidene-1H-quinazoline-7-carboxamide Traditional Name: 3-allyl-4-keto-N-[(1S)-1-phenylethyl]-2-thioxo-1H-quinazoline-7-carboxamide Formula: C20H19N3O2S MolecularWeight: 365.44876

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC=CC=C1)NC(=O)C2=CC3=C(C=C2)C(=O)N(C(=S)N3)CC=C

Isomeric SMILES

C[C@@H](C1=CC=CC=C1)NC(=O)C2=CC3=C(C=C2)C(=O)N(C(=S)N3)CC=C

InChI

InChI=1S/C20H19N3O2S/c1-3-11-23-19(25)16-10-9-15(12-17(16)22-20(23)26)18(24)21-13(2)14-7-5-4-6-8-14/h3-10,12-13H,1,11H2,2H3,(H,21,24)(H,22,26)/t13-/m0/s1