methyl 2-[(2R)-1-(aminocarbonylamino)-1-oxidanylidene-propan-2-yl]sulfanyl-3-butyl-4-oxidanylidene-quinazoline-7-carboxylate

Systemtic Name: methyl 2-[(2R)-1-(aminocarbonylamino)-1-oxidanylidene-propan-2-yl]sulfanyl-3-butyl-4-oxidanylidene-quinazoline-7-carboxylate Openeye Name: methyl 3-butyl-2-[(1R)-1-methyl-2-oxo-2-ureido-ethyl]sulfanyl-4-oxo-quinazoline-7-carboxylate CAS Name: 3-butyl-2-[[(2R)-1-(carbamoylamino)-1-oxopropan-2-yl]thio]-4-oxo-7-quinazolinecarboxylic acid methyl ester IUPAC Name: methyl 3-butyl-2-[(2R)-1-(carbamoylamino)-1-oxopropan-2-yl]sulfanyl-4-oxoquinazoline-7-carboxylate Traditional Name: 3-butyl-4-keto-2-[[(1R)-2-keto-1-methyl-2-ureido-ethyl]thio]quinazoline-7-carboxylic acid methyl ester Formula: C18H22N4O5S MolecularWeight: 406.45608

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C(=O)C2=C(C=C(C=C2)C(=O)OC)N=C1SC(C)C(=O)NC(=O)N

Isomeric SMILES

CCCCN1C(=O)C2=C(C=C(C=C2)C(=O)OC)N=C1S[C@H](C)C(=O)NC(=O)N

InChI

InChI=1S/C18H22N4O5S/c1-4-5-8-22-15(24)12-7-6-11(16(25)27-3)9-13(12)20-18(22)28-10(2)14(23)21-17(19)26/h6-7,9-10H,4-5,8H2,1-3H3,(H3,19,21,23,26)/t10-/m1/s1