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

Systemtic Name: 6-methyl-5-[3-[4-[(2-methylphenyl)methyl]-1,4-diazepan-1-yl]-3-oxidanylidene-propyl]-1H-pyrimidine-2,4-dione Openeye Name: 6-methyl-5-[3-[4-(o-tolylmethyl)-1,4-diazepan-1-yl]-3-oxo-propyl]-1H-pyrimidine-2,4-dione CAS Name: 6-methyl-5-[3-[4-[(2-methylphenyl)methyl]-1,4-diazepan-1-yl]-3-oxopropyl]-1H-pyrimidine-2,4-dione IUPAC Name: 6-methyl-5-[3-[4-[(2-methylphenyl)methyl]-1,4-diazepan-1-yl]-3-oxopropyl]-1H-pyrimidine-2,4-dione Traditional Name: 5-[3-keto-3-[4-(2-methylbenzyl)-1,4-diazepan-1-yl]propyl]-6-methyl-uracil Formula: C21H28N4O3 MolecularWeight: 384.47202

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1CN2CCCN(CC2)C(=O)CCC3=C(NC(=O)NC3=O)C

Isomeric SMILES

CC1=CC=CC=C1CN2CCCN(CC2)C(=O)CCC3=C(NC(=O)NC3=O)C

InChI

InChI=1S/C21H28N4O3/c1-15-6-3-4-7-17(15)14-24-10-5-11-25(13-12-24)19(26)9-8-18-16(2)22-21(28)23-20(18)27/h3-4,6-7H,5,8-14H2,1-2H3,(H2,22,23,27,28)