ethyl 6-(4-tert-butylphenyl)-4-(morpholin-4-ylmethyl)-2-oxidanylidene-3-prop-2-enyl-1,6-dihydropyrimidine-5-carboxylate

Systemtic Name: ethyl 6-(4-tert-butylphenyl)-4-(morpholin-4-ylmethyl)-2-oxidanylidene-3-prop-2-enyl-1,6-dihydropyrimidine-5-carboxylate Openeye Name: ethyl 3-allyl-6-(4-tert-butylphenyl)-4-(morpholinomethyl)-2-oxo-1,6-dihydropyrimidine-5-carboxylate CAS Name: 6-(4-tert-butylphenyl)-4-(4-morpholinylmethyl)-2-oxo-3-prop-2-enyl-1,6-dihydropyrimidine-5-carboxylic acid ethyl ester IUPAC Name: ethyl 6-(4-tert-butylphenyl)-4-(morpholin-4-ylmethyl)-2-oxo-3-prop-2-enyl-1,6-dihydropyrimidine-5-carboxylate Traditional Name: 3-allyl-6-(4-tert-butylphenyl)-2-keto-4-(morpholinomethyl)-1,6-dihydropyrimidine-5-carboxylic acid ethyl ester Formula: C25H35N3O4 MolecularWeight: 441.5631

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(N(C(=O)NC1C2=CC=C(C=C2)C(C)(C)C)CC=C)CN3CCOCC3

Isomeric SMILES

CCOC(=O)C1=C(N(C(=O)NC1C2=CC=C(C=C2)C(C)(C)C)CC=C)CN3CCOCC3

InChI

InChI=1S/C25H35N3O4/c1-6-12-28-20(17-27-13-15-31-16-14-27)21(23(29)32-7-2)22(26-24(28)30)18-8-10-19(11-9-18)25(3,4)5/h6,8-11,22H,1,7,12-17H2,2-5H3,(H,26,30)