6-azanyl-5-[2-[4-(1H-indol-3-yl)piperidin-1-ium-1-yl]ethanoyl]-3-methyl-1-(2-methylpropyl)pyrimidine-2,4-dione

Systemtic Name: 6-azanyl-5-[2-[4-(1H-indol-3-yl)piperidin-1-ium-1-yl]ethanoyl]-3-methyl-1-(2-methylpropyl)pyrimidine-2,4-dione Openeye Name: 6-amino-5-[2-[4-(1H-indol-3-yl)piperidin-1-ium-1-yl]acetyl]-1-isobutyl-3-methyl-pyrimidine-2,4-dione CAS Name: 6-amino-5-[2-[4-(1H-indol-3-yl)-1-piperidin-1-iumyl]-1-oxoethyl]-3-methyl-1-(2-methylpropyl)pyrimidine-2,4-dione IUPAC Name: 6-amino-5-[2-[4-(1H-indol-3-yl)piperidin-1-ium-1-yl]acetyl]-3-methyl-1-(2-methylpropyl)pyrimidine-2,4-dione Traditional Name: 6-amino-5-[2-[4-(1H-indol-3-yl)piperidin-1-ium-1-yl]acetyl]-1-isobutyl-3-methyl-pyrimidine-2,4-quinone Formula: C24H32N5O3+ MolecularWeight: 438.54258

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CN1C(=C(C(=O)N(C1=O)C)C(=O)C[NH+]2CCC(CC2)C3=CNC4=CC=CC=C43)N

Isomeric SMILES

CC(C)CN1C(=C(C(=O)N(C1=O)C)C(=O)C[NH+]2CCC(CC2)C3=CNC4=CC=CC=C43)N

InChI

InChI=1S/C24H31N5O3/c1-15(2)13-29-22(25)21(23(31)27(3)24(29)32)20(30)14-28-10-8-16(9-11-28)18-12-26-19-7-5-4-6-17(18)19/h4-7,12,15-16,26H,8-11,13-14,25H2,1-3H3/p+1