(phenylmethyl) 4-azanyl-5-(3-methoxy-4-phenylmethoxy-phenyl)-7-methyl-2-sulfanylidene-5,8-dihydro-3H-pyrido[2,3-d]pyrimidine-6-carboxylate

Systemtic Name: (phenylmethyl) 4-azanyl-5-(3-methoxy-4-phenylmethoxy-phenyl)-7-methyl-2-sulfanylidene-5,8-dihydro-3H-pyrido[2,3-d]pyrimidine-6-carboxylate Openeye Name: benzyl 4-amino-5-(4-benzyloxy-3-methoxy-phenyl)-7-methyl-2-thioxo-5,8-dihydro-3H-pyrido[2,3-d]pyrimidine-6-carboxylate CAS Name: 4-amino-5-(3-methoxy-4-phenylmethoxyphenyl)-7-methyl-2-sulfanylidene-5,8-dihydro-3H-pyrido[2,3-d]pyrimidine-6-carboxylic acid (phenylmethyl) ester IUPAC Name: benzyl 4-amino-5-(3-methoxy-4-phenylmethoxyphenyl)-7-methyl-2-sulfanylidene-5,8-dihydro-3H-pyrido[2,3-d]pyrimidine-6-carboxylate Traditional Name: 4-amino-5-(4-benzoxy-3-methoxy-phenyl)-7-methyl-2-thioxo-5,8-dihydro-3H-pyrido[2,3-d]pyrimidine-6-carboxylic acid benzyl ester Formula: C30H28N4O4S MolecularWeight: 540.63272

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(C2=C(NC(=S)N=C2N1)N)C3=CC(=C(C=C3)OCC4=CC=CC=C4)OC)C(=O)OCC5=CC=CC=C5

Isomeric SMILES

CC1=C(C(C2=C(NC(=S)N=C2N1)N)C3=CC(=C(C=C3)OCC4=CC=CC=C4)OC)C(=O)OCC5=CC=CC=C5

InChI

InChI=1S/C30H28N4O4S/c1-18-24(29(35)38-17-20-11-7-4-8-12-20)25(26-27(31)33-30(39)34-28(26)32-18)21-13-14-22(23(15-21)36-2)37-16-19-9-5-3-6-10-19/h3-15,25H,16-17H2,1-2H3,(H4,31,32,33,34,39)