2-methoxyethyl (4S,5R)-4-(2-methoxynaphthalen-1-yl)-6-methylidene-2-sulfanylidene-1,3-diazinane-5-carboxylate

Systemtic Name: 2-methoxyethyl (4S,5R)-4-(2-methoxynaphthalen-1-yl)-6-methylidene-2-sulfanylidene-1,3-diazinane-5-carboxylate Openeye Name: 2-methoxyethyl (4S,5R)-4-(2-methoxy-1-naphthyl)-6-methylene-2-thioxo-hexahydropyrimidine-5-carboxylate CAS Name: (4S,5R)-4-(2-methoxy-1-naphthalenyl)-6-methylene-2-sulfanylidene-1,3-diazinane-5-carboxylic acid 2-methoxyethyl ester IUPAC Name: 2-methoxyethyl (4S,5R)-4-(2-methoxynaphthalen-1-yl)-6-methylidene-2-sulfanylidene-1,3-diazinane-5-carboxylate Traditional Name: (4S,5R)-4-(2-methoxy-1-naphthyl)-6-methylene-2-thioxo-hexahydropyrimidine-5-carboxylic acid 2-methoxyethyl ester Formula: C20H22N2O4S MolecularWeight: 386.46468

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Descriptors Computed from Structure

Canonical SMILES:

COCCOC(=O)C1C(NC(=S)NC1=C)C2=C(C=CC3=CC=CC=C32)OC

Isomeric SMILES

COCCOC(=O)[C@@H]1[C@H](NC(=S)NC1=C)C2=C(C=CC3=CC=CC=C32)OC

InChI

InChI=1S/C20H22N2O4S/c1-12-16(19(23)26-11-10-24-2)18(22-20(27)21-12)17-14-7-5-4-6-13(14)8-9-15(17)25-3/h4-9,16,18H,1,10-11H2,2-3H3,(H2,21,22,27)/t16-,18-/m0/s1