3-(6-chloranyl-2-methylsulfanyl-5-nitro-pyrimidin-4-yl)oxy-2-[1-(dimethylamino)ethyl]-N,N-dimethyl-benzamide

Systemtic Name: 3-(6-chloranyl-2-methylsulfanyl-5-nitro-pyrimidin-4-yl)oxy-2-[1-(dimethylamino)ethyl]-N,N-dimethyl-benzamide Openeye Name: 3-(6-chloro-2-methylsulfanyl-5-nitro-pyrimidin-4-yl)oxy-2-[1-(dimethylamino)ethyl]-N,N-dimethyl-benzamide CAS Name: 3-[[6-chloro-2-(methylthio)-5-nitro-4-pyrimidinyl]oxy]-2-[1-(dimethylamino)ethyl]-N,N-dimethylbenzamide IUPAC Name: 3-(6-chloro-2-methylsulfanyl-5-nitropyrimidin-4-yl)oxy-2-[1-(dimethylamino)ethyl]-N,N-dimethylbenzamide Traditional Name: 3-[6-chloro-2-(methylthio)-5-nitro-pyrimidin-4-yl]oxy-2-[1-(dimethylamino)ethyl]-N,N-dimethyl-benzamide Formula: C18H22ClN5O4S MolecularWeight: 439.91638

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=C(C=CC=C1OC2=C(C(=NC(=N2)SC)Cl)[N+](=O)[O-])C(=O)N(C)C)N(C)C

Isomeric SMILES

CC(C1=C(C=CC=C1OC2=C(C(=NC(=N2)SC)Cl)[N+](=O)[O-])C(=O)N(C)C)N(C)C

InChI

InChI=1S/C18H22ClN5O4S/c1-10(22(2)3)13-11(17(25)23(4)5)8-7-9-12(13)28-16-14(24(26)27)15(19)20-18(21-16)29-6/h7-10H,1-6H3