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2-(3-chlorophenyl)ethyl 4-[2-(methoxycarbonylamino)ethoxycarbonyloxymethyl]-6-methyl-2-sulfanylidene-3,4-dihydro-1H-pyrimidine-5-carboxylate

2-(3-chlorophenyl)ethyl 4-[2-(methoxycarbonylamino)ethoxycarbonyloxymethyl]-6-methyl-2-sulfanylidene-3,4-dihydro-1H-pyrimidine-5-carboxylate

Systemtic Name:2-(3-chlorophenyl)ethyl 4-[2-(methoxycarbonylamino)ethoxycarbonyloxymethyl]-6-methyl-2-sulfanylidene-3,4-dihydro-1H-pyrimidine-5-carboxylate
Openeye Name:2-(3-chlorophenyl)ethyl 4-[2-(methoxycarbonylamino)ethoxycarbonyloxymethyl]-6-methyl-2-thioxo-3,4-dihydro-1H-pyrimidine-5-carboxylate
CAS Name:4-[[2-(methoxycarbonylamino)ethoxy-oxomethoxy]methyl]-6-methyl-2-sulfanylidene-3,4-dihydro-1H-pyrimidine-5-carboxylic acid 2-(3-chlorophenyl)ethyl ester
IUPAC Name:2-(3-chlorophenyl)ethyl 4-[2-(methoxycarbonylamino)ethoxycarbonyloxymethyl]-6-methyl-2-sulfanylidene-3,4-dihydro-1H-pyrimidine-5-carboxylate
Traditional Name:4-[2-(carbomethoxyamino)ethoxycarbonyloxymethyl]-6-methyl-2-thioxo-3,4-dihydro-1H-pyrimidine-5-carboxylic acid 2-(3-chlorophenyl)ethyl ester
Formula: C20H24ClN3O7S
MolecularWeight: 485.93846
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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(NC(=S)N1)COC(=O)OCCNC(=O)OC)C(=O)OCCC2=CC(=CC=C2)Cl


Isomeric SMILES

CC1=C(C(NC(=S)N1)COC(=O)OCCNC(=O)OC)C(=O)OCCC2=CC(=CC=C2)Cl


InChI

InChI=1S/C20H24ClN3O7S/c1-12-16(17(25)29-8-6-13-4-3-5-14(21)10-13)15(24-18(32)23-12)11-31-20(27)30-9-7-22-19(26)28-2/h3-5,10,15H,6-9,11H2,1-2H3,(H,22,26)(H2,23,24,32)


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