ethyl 4-[3-ethoxy-4-[(4-methylphenyl)methoxy]phenyl]-6-methylidene-2-sulfanylidene-1,3-diazinane-5-carboxylate

Systemtic Name: ethyl 4-[3-ethoxy-4-[(4-methylphenyl)methoxy]phenyl]-6-methylidene-2-sulfanylidene-1,3-diazinane-5-carboxylate Openeye Name: ethyl 4-[3-ethoxy-4-(p-tolylmethoxy)phenyl]-6-methylene-2-thioxo-hexahydropyrimidine-5-carboxylate CAS Name: 4-[3-ethoxy-4-[(4-methylphenyl)methoxy]phenyl]-6-methylene-2-sulfanylidene-1,3-diazinane-5-carboxylic acid ethyl ester IUPAC Name: ethyl 4-[3-ethoxy-4-[(4-methylphenyl)methoxy]phenyl]-6-methylidene-2-sulfanylidene-1,3-diazinane-5-carboxylate Traditional Name: 4-[3-ethoxy-4-(4-methylbenzyl)oxy-phenyl]-6-methylene-2-thioxo-hexahydropyrimidine-5-carboxylic acid ethyl ester Formula: C24H28N2O4S MolecularWeight: 440.55512

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=CC(=C1)C2C(C(=C)NC(=S)N2)C(=O)OCC)OCC3=CC=C(C=C3)C

Isomeric SMILES

CCOC1=C(C=CC(=C1)C2C(C(=C)NC(=S)N2)C(=O)OCC)OCC3=CC=C(C=C3)C

InChI

InChI=1S/C24H28N2O4S/c1-5-28-20-13-18(11-12-19(20)30-14-17-9-7-15(3)8-10-17)22-21(23(27)29-6-2)16(4)25-24(31)26-22/h7-13,21-22H,4-6,14H2,1-3H3,(H2,25,26,31)