methyl 4-[[6-azanyl-1-butyl-2,4-bis(oxidanylidene)pyrimidin-5-yl]-(phenylmethyl)carbamoyl]benzoate

Systemtic Name: methyl 4-[[6-azanyl-1-butyl-2,4-bis(oxidanylidene)pyrimidin-5-yl]-(phenylmethyl)carbamoyl]benzoate Openeye Name: methyl 4-[(6-amino-1-butyl-2,4-dioxo-pyrimidin-5-yl)-benzyl-carbamoyl]benzoate CAS Name: 4-[[(6-amino-1-butyl-2,4-dioxo-5-pyrimidinyl)-(phenylmethyl)amino]-oxomethyl]benzoic acid methyl ester IUPAC Name: methyl 4-[(6-amino-1-butyl-2,4-dioxopyrimidin-5-yl)-benzylcarbamoyl]benzoate Traditional Name: 4-[(6-amino-1-butyl-2,4-diketo-pyrimidin-5-yl)-benzyl-carbamoyl]benzoic acid methyl ester Formula: C24H26N4O5 MolecularWeight: 450.48704

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C(=C(C(=O)NC1=O)N(CC2=CC=CC=C2)C(=O)C3=CC=C(C=C3)C(=O)OC)N

Isomeric SMILES

CCCCN1C(=C(C(=O)NC1=O)N(CC2=CC=CC=C2)C(=O)C3=CC=C(C=C3)C(=O)OC)N

InChI

InChI=1S/C24H26N4O5/c1-3-4-14-27-20(25)19(21(29)26-24(27)32)28(15-16-8-6-5-7-9-16)22(30)17-10-12-18(13-11-17)23(31)33-2/h5-13H,3-4,14-15,25H2,1-2H3,(H,26,29,32)