N,N-dimethyl-4-[3-(6-methyl-2-methylsulfanyl-4-oxidanylidene-1H-pyrimidin-5-yl)propanoyl]-2,3-dihydro-1,4-benzoxazine-2-carboxamide

Systemtic Name: N,N-dimethyl-4-[3-(6-methyl-2-methylsulfanyl-4-oxidanylidene-1H-pyrimidin-5-yl)propanoyl]-2,3-dihydro-1,4-benzoxazine-2-carboxamide Openeye Name: N,N-dimethyl-4-[3-(6-methyl-2-methylsulfanyl-4-oxo-1H-pyrimidin-5-yl)propanoyl]-2,3-dihydro-1,4-benzoxazine-2-carboxamide CAS Name: N,N-dimethyl-4-[3-[6-methyl-2-(methylthio)-4-oxo-1H-pyrimidin-5-yl]-1-oxopropyl]-2,3-dihydro-1,4-benzoxazine-2-carboxamide IUPAC Name: N,N-dimethyl-4-[3-(6-methyl-2-methylsulfanyl-4-oxo-1H-pyrimidin-5-yl)propanoyl]-2,3-dihydro-1,4-benzoxazine-2-carboxamide Traditional Name: 4-[3-[4-keto-6-methyl-2-(methylthio)-1H-pyrimidin-5-yl]propanoyl]-N,N-dimethyl-2,3-dihydro-1,4-benzoxazine-2-carboxamide Formula: C20H24N4O4S MolecularWeight: 416.49396

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=O)N=C(N1)SC)CCC(=O)N2CC(OC3=CC=CC=C32)C(=O)N(C)C

Isomeric SMILES

CC1=C(C(=O)N=C(N1)SC)CCC(=O)N2CC(OC3=CC=CC=C32)C(=O)N(C)C

InChI

InChI=1S/C20H24N4O4S/c1-12-13(18(26)22-20(21-12)29-4)9-10-17(25)24-11-16(19(27)23(2)3)28-15-8-6-5-7-14(15)24/h5-8,16H,9-11H2,1-4H3,(H,21,22,26)