ethyl (4S)-4-[4-(naphthalen-1-ylmethoxy)phenyl]-6-phenyl-2-sulfanylidene-3,4-dihydro-1H-pyrimidine-5-carboxylate

Systemtic Name: ethyl (4S)-4-[4-(naphthalen-1-ylmethoxy)phenyl]-6-phenyl-2-sulfanylidene-3,4-dihydro-1H-pyrimidine-5-carboxylate Openeye Name: ethyl (4S)-4-[4-(1-naphthylmethoxy)phenyl]-6-phenyl-2-thioxo-3,4-dihydro-1H-pyrimidine-5-carboxylate CAS Name: (4S)-4-[4-(1-naphthalenylmethoxy)phenyl]-6-phenyl-2-sulfanylidene-3,4-dihydro-1H-pyrimidine-5-carboxylic acid ethyl ester IUPAC Name: ethyl (4S)-4-[4-(naphthalen-1-ylmethoxy)phenyl]-6-phenyl-2-sulfanylidene-3,4-dihydro-1H-pyrimidine-5-carboxylate Traditional Name: (4S)-4-[4-(1-naphthylmethoxy)phenyl]-6-phenyl-2-thioxo-3,4-dihydro-1H-pyrimidine-5-carboxylic acid ethyl ester Formula: C30H26N2O3S MolecularWeight: 494.60404

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(NC(=S)NC1C2=CC=C(C=C2)OCC3=CC=CC4=CC=CC=C43)C5=CC=CC=C5

Isomeric SMILES

CCOC(=O)C1=C(NC(=S)N[C@H]1C2=CC=C(C=C2)OCC3=CC=CC4=CC=CC=C43)C5=CC=CC=C5

InChI

InChI=1S/C30H26N2O3S/c1-2-34-29(33)26-27(21-10-4-3-5-11-21)31-30(36)32-28(26)22-15-17-24(18-16-22)35-19-23-13-8-12-20-9-6-7-14-25(20)23/h3-18,28H,2,19H2,1H3,(H2,31,32,36)/t28-/m0/s1