N-[(1R)-1-cyclopropylethyl]-2-(4-oxidanylidene-3-prop-2-enyl-quinazolin-2-yl)sulfanyl-N-(phenylmethyl)ethanamide

Systemtic Name: N-[(1R)-1-cyclopropylethyl]-2-(4-oxidanylidene-3-prop-2-enyl-quinazolin-2-yl)sulfanyl-N-(phenylmethyl)ethanamide Openeye Name: 2-(3-allyl-4-oxo-quinazolin-2-yl)sulfanyl-N-benzyl-N-[(1R)-1-cyclopropylethyl]acetamide CAS Name: N-[(1R)-1-cyclopropylethyl]-2-[(4-oxo-3-prop-2-enyl-2-quinazolinyl)thio]-N-(phenylmethyl)acetamide IUPAC Name: N-benzyl-N-[(1R)-1-cyclopropylethyl]-2-(4-oxo-3-prop-2-enylquinazolin-2-yl)sulfanylacetamide Traditional Name: 2-[(3-allyl-4-keto-quinazolin-2-yl)thio]-N-benzyl-N-[(1R)-1-cyclopropylethyl]acetamide Formula: C25H27N3O2S MolecularWeight: 433.56578

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1CC1)N(CC2=CC=CC=C2)C(=O)CSC3=NC4=CC=CC=C4C(=O)N3CC=C

Isomeric SMILES

C[C@H](C1CC1)N(CC2=CC=CC=C2)C(=O)CSC3=NC4=CC=CC=C4C(=O)N3CC=C

InChI

InChI=1S/C25H27N3O2S/c1-3-15-27-24(30)21-11-7-8-12-22(21)26-25(27)31-17-23(29)28(18(2)20-13-14-20)16-19-9-5-4-6-10-19/h3-12,18,20H,1,13-17H2,2H3/t18-/m1/s1