2-methoxyethyl (6S)-6-[4-(butylcarbamoylamino)phenyl]-3,4-dimethyl-2-oxidanylidene-1,6-dihydropyrimidine-5-carboxylate

Systemtic Name: 2-methoxyethyl (6S)-6-[4-(butylcarbamoylamino)phenyl]-3,4-dimethyl-2-oxidanylidene-1,6-dihydropyrimidine-5-carboxylate Openeye Name: 2-methoxyethyl (6S)-6-[4-(butylcarbamoylamino)phenyl]-3,4-dimethyl-2-oxo-1,6-dihydropyrimidine-5-carboxylate CAS Name: (6S)-6-[4-[[butylamino(oxo)methyl]amino]phenyl]-3,4-dimethyl-2-oxo-1,6-dihydropyrimidine-5-carboxylic acid 2-methoxyethyl ester IUPAC Name: 2-methoxyethyl (6S)-6-[4-(butylcarbamoylamino)phenyl]-3,4-dimethyl-2-oxo-1,6-dihydropyrimidine-5-carboxylate Traditional Name: (6S)-6-[4-(butylcarbamoylamino)phenyl]-2-keto-3,4-dimethyl-1,6-dihydropyrimidine-5-carboxylic acid 2-methoxyethyl ester Formula: C21H30N4O5 MolecularWeight: 418.4867

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Descriptors Computed from Structure

Canonical SMILES:

CCCCNC(=O)NC1=CC=C(C=C1)C2C(=C(N(C(=O)N2)C)C)C(=O)OCCOC

Isomeric SMILES

CCCCNC(=O)NC1=CC=C(C=C1)[C@H]2C(=C(N(C(=O)N2)C)C)C(=O)OCCOC

InChI

InChI=1S/C21H30N4O5/c1-5-6-11-22-20(27)23-16-9-7-15(8-10-16)18-17(19(26)30-13-12-29-4)14(2)25(3)21(28)24-18/h7-10,18H,5-6,11-13H2,1-4H3,(H,24,28)(H2,22,23,27)/t18-/m0/s1