ethyl 1-[2-(naphthalen-1-ylamino)-2-oxidanylidene-ethyl]-6-oxidanylidene-2-phenethylsulfanyl-pyrimidine-5-carboxylate

Systemtic Name: ethyl 1-[2-(naphthalen-1-ylamino)-2-oxidanylidene-ethyl]-6-oxidanylidene-2-phenethylsulfanyl-pyrimidine-5-carboxylate Openeye Name: ethyl 1-[2-(1-naphthylamino)-2-oxo-ethyl]-6-oxo-2-phenethylsulfanyl-pyrimidine-5-carboxylate CAS Name: 1-[2-(1-naphthalenylamino)-2-oxoethyl]-6-oxo-2-(phenethylthio)-5-pyrimidinecarboxylic acid ethyl ester IUPAC Name: ethyl 1-[2-(naphthalen-1-ylamino)-2-oxoethyl]-6-oxo-2-phenethylsulfanylpyrimidine-5-carboxylate Traditional Name: 6-keto-1-[2-keto-2-(1-naphthylamino)ethyl]-2-(phenethylthio)pyrimidine-5-carboxylic acid ethyl ester Formula: C27H25N3O4S MolecularWeight: 487.5701

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CN=C(N(C1=O)CC(=O)NC2=CC=CC3=CC=CC=C32)SCCC4=CC=CC=C4

Isomeric SMILES

CCOC(=O)C1=CN=C(N(C1=O)CC(=O)NC2=CC=CC3=CC=CC=C32)SCCC4=CC=CC=C4

InChI

InChI=1S/C27H25N3O4S/c1-2-34-26(33)22-17-28-27(35-16-15-19-9-4-3-5-10-19)30(25(22)32)18-24(31)29-23-14-8-12-20-11-6-7-13-21(20)23/h3-14,17H,2,15-16,18H2,1H3,(H,29,31)