N-[6-azanyl-1-butyl-2,4-bis(oxidanylidene)pyrimidin-5-yl]-N-(3-methylbutyl)-2-(4-pyrrol-1-ylphenyl)ethanamide

Systemtic Name: N-[6-azanyl-1-butyl-2,4-bis(oxidanylidene)pyrimidin-5-yl]-N-(3-methylbutyl)-2-(4-pyrrol-1-ylphenyl)ethanamide Openeye Name: N-(6-amino-1-butyl-2,4-dioxo-pyrimidin-5-yl)-N-isopentyl-2-(4-pyrrol-1-ylphenyl)acetamide CAS Name: N-(6-amino-1-butyl-2,4-dioxo-5-pyrimidinyl)-N-(3-methylbutyl)-2-[4-(1-pyrrolyl)phenyl]acetamide IUPAC Name: N-(6-amino-1-butyl-2,4-dioxopyrimidin-5-yl)-N-(3-methylbutyl)-2-(4-pyrrol-1-ylphenyl)acetamide Traditional Name: N-(6-amino-1-butyl-2,4-diketo-pyrimidin-5-yl)-N-isoamyl-2-(4-pyrrol-1-ylphenyl)acetamide Formula: C25H33N5O3 MolecularWeight: 451.56122

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C(=C(C(=O)NC1=O)N(CCC(C)C)C(=O)CC2=CC=C(C=C2)N3C=CC=C3)N

Isomeric SMILES

CCCCN1C(=C(C(=O)NC1=O)N(CCC(C)C)C(=O)CC2=CC=C(C=C2)N3C=CC=C3)N

InChI

InChI=1S/C25H33N5O3/c1-4-5-15-30-23(26)22(24(32)27-25(30)33)29(16-12-18(2)3)21(31)17-19-8-10-20(11-9-19)28-13-6-7-14-28/h6-11,13-14,18H,4-5,12,15-17,26H2,1-3H3,(H,27,32,33)