6-azanyl-1-(2-methylpropyl)-5-[2-methylpropyl-[2-oxidanylidene-2-(4-thiophen-2-ylcarbonylpiperazin-1-yl)ethyl]amino]pyrimidine-2,4-dione

Systemtic Name: 6-azanyl-1-(2-methylpropyl)-5-[2-methylpropyl-[2-oxidanylidene-2-(4-thiophen-2-ylcarbonylpiperazin-1-yl)ethyl]amino]pyrimidine-2,4-dione Openeye Name: 6-amino-1-isobutyl-5-[isobutyl-[2-oxo-2-[4-(thiophene-2-carbonyl)piperazin-1-yl]ethyl]amino]pyrimidine-2,4-dione CAS Name: 6-amino-1-(2-methylpropyl)-5-[2-methylpropyl-[2-oxo-2-[4-[oxo(thiophen-2-yl)methyl]-1-piperazinyl]ethyl]amino]pyrimidine-2,4-dione IUPAC Name: 6-amino-1-(2-methylpropyl)-5-[2-methylpropyl-[2-oxo-2-[4-(thiophene-2-carbonyl)piperazin-1-yl]ethyl]amino]pyrimidine-2,4-dione Traditional Name: 6-amino-1-isobutyl-5-[isobutyl-[2-keto-2-[4-(2-thenoyl)piperazino]ethyl]amino]pyrimidine-2,4-quinone Formula: C23H34N6O4S MolecularWeight: 490.61886

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CN1C(=C(C(=O)NC1=O)N(CC(C)C)CC(=O)N2CCN(CC2)C(=O)C3=CC=CS3)N

Isomeric SMILES

CC(C)CN1C(=C(C(=O)NC1=O)N(CC(C)C)CC(=O)N2CCN(CC2)C(=O)C3=CC=CS3)N

InChI

InChI=1S/C23H34N6O4S/c1-15(2)12-28(19-20(24)29(13-16(3)4)23(33)25-21(19)31)14-18(30)26-7-9-27(10-8-26)22(32)17-6-5-11-34-17/h5-6,11,15-16H,7-10,12-14,24H2,1-4H3,(H,25,31,33)