N-[6-azanyl-2,4-bis(oxidanylidene)-1-(phenylmethyl)pyrimidin-5-yl]-3-methyl-N-(3-oxidanylpropyl)benzamide

Systemtic Name: N-[6-azanyl-2,4-bis(oxidanylidene)-1-(phenylmethyl)pyrimidin-5-yl]-3-methyl-N-(3-oxidanylpropyl)benzamide Openeye Name: N-(6-amino-1-benzyl-2,4-dioxo-pyrimidin-5-yl)-N-(3-hydroxypropyl)-3-methyl-benzamide CAS Name: N-[6-amino-2,4-dioxo-1-(phenylmethyl)-5-pyrimidinyl]-N-(3-hydroxypropyl)-3-methylbenzamide IUPAC Name: N-(6-amino-1-benzyl-2,4-dioxopyrimidin-5-yl)-N-(3-hydroxypropyl)-3-methylbenzamide Traditional Name: N-(6-amino-1-benzyl-2,4-diketo-pyrimidin-5-yl)-N-(3-hydroxypropyl)-3-methyl-benzamide Formula: C22H24N4O4 MolecularWeight: 408.45036

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC(=C1)C(=O)N(CCCO)C2=C(N(C(=O)NC2=O)CC3=CC=CC=C3)N

Isomeric SMILES

CC1=CC=CC(=C1)C(=O)N(CCCO)C2=C(N(C(=O)NC2=O)CC3=CC=CC=C3)N

InChI

InChI=1S/C22H24N4O4/c1-15-7-5-10-17(13-15)21(29)25(11-6-12-27)18-19(23)26(22(30)24-20(18)28)14-16-8-3-2-4-9-16/h2-5,7-10,13,27H,6,11-12,14,23H2,1H3,(H,24,28,30)