2-[2-[2-(1-cyclopropylethylamino)-2-oxidanylidene-ethyl]sulfanyl-4-oxidanylidene-quinazolin-3-yl]ethanoic acid

Systemtic Name: 2-[2-[2-(1-cyclopropylethylamino)-2-oxidanylidene-ethyl]sulfanyl-4-oxidanylidene-quinazolin-3-yl]ethanoic acid Openeye Name: 2-[2-[2-(1-cyclopropylethylamino)-2-oxo-ethyl]sulfanyl-4-oxo-quinazolin-3-yl]acetic acid CAS Name: 2-[2-[[2-(1-cyclopropylethylamino)-2-oxoethyl]thio]-4-oxo-3-quinazolinyl]acetic acid IUPAC Name: 2-[2-[2-(1-cyclopropylethylamino)-2-oxoethyl]sulfanyl-4-oxoquinazolin-3-yl]acetic acid Traditional Name: 2-[2-[[2-(1-cyclopropylethylamino)-2-keto-ethyl]thio]-4-keto-quinazolin-3-yl]acetic acid Formula: C17H19N3O4S MolecularWeight: 361.41546

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1CC1)NC(=O)CSC2=NC3=CC=CC=C3C(=O)N2CC(=O)O

Isomeric SMILES

CC(C1CC1)NC(=O)CSC2=NC3=CC=CC=C3C(=O)N2CC(=O)O

InChI

InChI=1S/C17H19N3O4S/c1-10(11-6-7-11)18-14(21)9-25-17-19-13-5-3-2-4-12(13)16(24)20(17)8-15(22)23/h2-5,10-11H,6-9H2,1H3,(H,18,21)(H,22,23)