6-methyl-5-[3-oxidanylidene-3-[4-(thiophen-2-ylmethyl)-1,4-diazepan-1-yl]propyl]-1H-pyrimidine-2,4-dione

Systemtic Name: 6-methyl-5-[3-oxidanylidene-3-[4-(thiophen-2-ylmethyl)-1,4-diazepan-1-yl]propyl]-1H-pyrimidine-2,4-dione Openeye Name: 6-methyl-5-[3-oxo-3-[4-(2-thienylmethyl)-1,4-diazepan-1-yl]propyl]-1H-pyrimidine-2,4-dione CAS Name: 6-methyl-5-[3-oxo-3-[4-(thiophen-2-ylmethyl)-1,4-diazepan-1-yl]propyl]-1H-pyrimidine-2,4-dione IUPAC Name: 6-methyl-5-[3-oxo-3-[4-(thiophen-2-ylmethyl)-1,4-diazepan-1-yl]propyl]-1H-pyrimidine-2,4-dione Traditional Name: 5-[3-keto-3-[4-(2-thenyl)-1,4-diazepan-1-yl]propyl]-6-methyl-uracil Formula: C18H24N4O3S MolecularWeight: 376.47316

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=O)NC(=O)N1)CCC(=O)N2CCCN(CC2)CC3=CC=CS3

Isomeric SMILES

CC1=C(C(=O)NC(=O)N1)CCC(=O)N2CCCN(CC2)CC3=CC=CS3

InChI

InChI=1S/C18H24N4O3S/c1-13-15(17(24)20-18(25)19-13)5-6-16(23)22-8-3-7-21(9-10-22)12-14-4-2-11-26-14/h2,4,11H,3,5-10,12H2,1H3,(H2,19,20,24,25)