ethyl 5-[[6-azanyl-1-butyl-2,4-bis(oxidanylidene)pyrimidin-5-yl]-butyl-carbamoyl]-1H-indole-2-carboxylate

Systemtic Name: ethyl 5-[[6-azanyl-1-butyl-2,4-bis(oxidanylidene)pyrimidin-5-yl]-butyl-carbamoyl]-1H-indole-2-carboxylate Openeye Name: ethyl 5-[(6-amino-1-butyl-2,4-dioxo-pyrimidin-5-yl)-butyl-carbamoyl]-1H-indole-2-carboxylate CAS Name: 5-[[(6-amino-1-butyl-2,4-dioxo-5-pyrimidinyl)-butylamino]-oxomethyl]-1H-indole-2-carboxylic acid ethyl ester IUPAC Name: ethyl 5-[(6-amino-1-butyl-2,4-dioxopyrimidin-5-yl)-butylcarbamoyl]-1H-indole-2-carboxylate Traditional Name: 5-[(6-amino-1-butyl-2,4-diketo-pyrimidin-5-yl)-butyl-carbamoyl]-1H-indole-2-carboxylic acid ethyl ester Formula: C24H31N5O5 MolecularWeight: 469.53344

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C(=C(C(=O)NC1=O)N(CCCC)C(=O)C2=CC3=C(C=C2)NC(=C3)C(=O)OCC)N

Isomeric SMILES

CCCCN1C(=C(C(=O)NC1=O)N(CCCC)C(=O)C2=CC3=C(C=C2)NC(=C3)C(=O)OCC)N

InChI

InChI=1S/C24H31N5O5/c1-4-7-11-28(19-20(25)29(12-8-5-2)24(33)27-21(19)30)22(31)15-9-10-17-16(13-15)14-18(26-17)23(32)34-6-3/h9-10,13-14,26H,4-8,11-12,25H2,1-3H3,(H,27,30,33)