4-oxidanylidene-N-[(2R)-4-phenylbutan-2-yl]-3-prop-2-enyl-2-sulfanylidene-1H-quinazoline-7-carboxamide

Systemtic Name: 4-oxidanylidene-N-[(2R)-4-phenylbutan-2-yl]-3-prop-2-enyl-2-sulfanylidene-1H-quinazoline-7-carboxamide Openeye Name: 3-allyl-N-[(1R)-1-methyl-3-phenyl-propyl]-4-oxo-2-thioxo-1H-quinazoline-7-carboxamide CAS Name: 4-oxo-N-[(2R)-4-phenylbutan-2-yl]-3-prop-2-enyl-2-sulfanylidene-1H-quinazoline-7-carboxamide IUPAC Name: 4-oxo-N-[(2R)-4-phenylbutan-2-yl]-3-prop-2-enyl-2-sulfanylidene-1H-quinazoline-7-carboxamide Traditional Name: 3-allyl-4-keto-N-[(1R)-1-methyl-3-phenyl-propyl]-2-thioxo-1H-quinazoline-7-carboxamide Formula: C22H23N3O2S MolecularWeight: 393.50192

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Descriptors Computed from Structure

Canonical SMILES:

CC(CCC1=CC=CC=C1)NC(=O)C2=CC3=C(C=C2)C(=O)N(C(=S)N3)CC=C

Isomeric SMILES

C[C@H](CCC1=CC=CC=C1)NC(=O)C2=CC3=C(C=C2)C(=O)N(C(=S)N3)CC=C

InChI

InChI=1S/C22H23N3O2S/c1-3-13-25-21(27)18-12-11-17(14-19(18)24-22(25)28)20(26)23-15(2)9-10-16-7-5-4-6-8-16/h3-8,11-12,14-15H,1,9-10,13H2,2H3,(H,23,26)(H,24,28)/t15-/m1/s1