ethyl 4-[[3-methyl-4-(propan-2-ylcarbamoyl)piperazin-1-yl]methyl]-2-oxidanylidene-6-(3-phenoxyphenyl)-3-prop-2-enyl-1,6-dihydropyrimidine-5-carboxylate

Systemtic Name: ethyl 4-[[3-methyl-4-(propan-2-ylcarbamoyl)piperazin-1-yl]methyl]-2-oxidanylidene-6-(3-phenoxyphenyl)-3-prop-2-enyl-1,6-dihydropyrimidine-5-carboxylate Openeye Name: ethyl 3-allyl-4-[[4-(isopropylcarbamoyl)-3-methyl-piperazin-1-yl]methyl]-2-oxo-6-(3-phenoxyphenyl)-1,6-dihydropyrimidine-5-carboxylate CAS Name: 4-[[3-methyl-4-[oxo-(propan-2-ylamino)methyl]-1-piperazinyl]methyl]-2-oxo-6-(3-phenoxyphenyl)-3-prop-2-enyl-1,6-dihydropyrimidine-5-carboxylic acid ethyl ester IUPAC Name: ethyl 4-[[3-methyl-4-(propan-2-ylcarbamoyl)piperazin-1-yl]methyl]-2-oxo-6-(3-phenoxyphenyl)-3-prop-2-enyl-1,6-dihydropyrimidine-5-carboxylate Traditional Name: 3-allyl-4-[[4-(isopropylcarbamoyl)-3-methyl-piperazino]methyl]-2-keto-6-(3-phenoxyphenyl)-1,6-dihydropyrimidine-5-carboxylic acid ethyl ester Formula: C32H41N5O5 MolecularWeight: 575.69844

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(N(C(=O)NC1C2=CC(=CC=C2)OC3=CC=CC=C3)CC=C)CN4CCN(C(C4)C)C(=O)NC(C)C

Isomeric SMILES

CCOC(=O)C1=C(N(C(=O)NC1C2=CC(=CC=C2)OC3=CC=CC=C3)CC=C)CN4CCN(C(C4)C)C(=O)NC(C)C

InChI

InChI=1S/C32H41N5O5/c1-6-16-37-27(21-35-17-18-36(23(5)20-35)31(39)33-22(3)4)28(30(38)41-7-2)29(34-32(37)40)24-12-11-15-26(19-24)42-25-13-9-8-10-14-25/h6,8-15,19,22-23,29H,1,7,16-18,20-21H2,2-5H3,(H,33,39)(H,34,40)