6-azanyl-5-[2-[4-(phenylmethyl)-1,4-diazepan-1-yl]ethanoyl]-1-propyl-pyrimidine-2,4-dione

Systemtic Name: 6-azanyl-5-[2-[4-(phenylmethyl)-1,4-diazepan-1-yl]ethanoyl]-1-propyl-pyrimidine-2,4-dione Openeye Name: 6-amino-5-[2-(4-benzyl-1,4-diazepan-1-yl)acetyl]-1-propyl-pyrimidine-2,4-dione CAS Name: 6-amino-5-[1-oxo-2-[4-(phenylmethyl)-1,4-diazepan-1-yl]ethyl]-1-propylpyrimidine-2,4-dione IUPAC Name: 6-amino-5-[2-(4-benzyl-1,4-diazepan-1-yl)acetyl]-1-propylpyrimidine-2,4-dione Traditional Name: 6-amino-5-[2-(4-benzyl-1,4-diazepan-1-yl)acetyl]-1-propyl-pyrimidine-2,4-quinone Formula: C21H29N5O3 MolecularWeight: 399.48666

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Descriptors Computed from Structure

Canonical SMILES:

CCCN1C(=C(C(=O)NC1=O)C(=O)CN2CCCN(CC2)CC3=CC=CC=C3)N

Isomeric SMILES

CCCN1C(=C(C(=O)NC1=O)C(=O)CN2CCCN(CC2)CC3=CC=CC=C3)N

InChI

InChI=1S/C21H29N5O3/c1-2-9-26-19(22)18(20(28)23-21(26)29)17(27)15-25-11-6-10-24(12-13-25)14-16-7-4-3-5-8-16/h3-5,7-8H,2,6,9-15,22H2,1H3,(H,23,28,29)