methyl N-[(2R)-2-[3-(2,6-dimethylphenyl)-4-oxidanylidene-quinazolin-2-yl]sulfanylpropanoyl]carbamate

Systemtic Name: methyl N-[(2R)-2-[3-(2,6-dimethylphenyl)-4-oxidanylidene-quinazolin-2-yl]sulfanylpropanoyl]carbamate Openeye Name: methyl N-[(2R)-2-[3-(2,6-dimethylphenyl)-4-oxo-quinazolin-2-yl]sulfanylpropanoyl]carbamate CAS Name: N-[(2R)-2-[[3-(2,6-dimethylphenyl)-4-oxo-2-quinazolinyl]thio]-1-oxopropyl]carbamic acid methyl ester IUPAC Name: methyl N-[(2R)-2-[3-(2,6-dimethylphenyl)-4-oxoquinazolin-2-yl]sulfanylpropanoyl]carbamate Traditional Name: N-[(2R)-2-[[3-(2,6-dimethylphenyl)-4-keto-quinazolin-2-yl]thio]propanoyl]carbamic acid methyl ester Formula: C21H21N3O4S MolecularWeight: 411.47414

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC=C1)C)N2C(=O)C3=CC=CC=C3N=C2SC(C)C(=O)NC(=O)OC

Isomeric SMILES

CC1=C(C(=CC=C1)C)N2C(=O)C3=CC=CC=C3N=C2S[C@H](C)C(=O)NC(=O)OC

InChI

InChI=1S/C21H21N3O4S/c1-12-8-7-9-13(2)17(12)24-19(26)15-10-5-6-11-16(15)22-20(24)29-14(3)18(25)23-21(27)28-4/h5-11,14H,1-4H3,(H,23,25,27)/t14-/m1/s1