methyl N-[(2R)-2-[3-(3-methylbutyl)-4-oxidanylidene-quinazolin-2-yl]sulfanylpropanoyl]carbamate

Systemtic Name: methyl N-[(2R)-2-[3-(3-methylbutyl)-4-oxidanylidene-quinazolin-2-yl]sulfanylpropanoyl]carbamate Openeye Name: methyl N-[(2R)-2-(3-isopentyl-4-oxo-quinazolin-2-yl)sulfanylpropanoyl]carbamate CAS Name: N-[(2R)-2-[[3-(3-methylbutyl)-4-oxo-2-quinazolinyl]thio]-1-oxopropyl]carbamic acid methyl ester IUPAC Name: methyl N-[(2R)-2-[3-(3-methylbutyl)-4-oxoquinazolin-2-yl]sulfanylpropanoyl]carbamate Traditional Name: N-[(2R)-2-[(3-isoamyl-4-keto-quinazolin-2-yl)thio]propanoyl]carbamic acid methyl ester Formula: C18H23N3O4S MolecularWeight: 377.45792

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCN1C(=O)C2=CC=CC=C2N=C1SC(C)C(=O)NC(=O)OC

Isomeric SMILES

C[C@H](C(=O)NC(=O)OC)SC1=NC2=CC=CC=C2C(=O)N1CCC(C)C

InChI

InChI=1S/C18H23N3O4S/c1-11(2)9-10-21-16(23)13-7-5-6-8-14(13)19-17(21)26-12(3)15(22)20-18(24)25-4/h5-8,11-12H,9-10H2,1-4H3,(H,20,22,24)/t12-/m1/s1