N-[3-(2-azanyl-6-methyl-4-oxidanylidene-1H-pyrimidin-5-yl)propyl]-4-(bromomethyl)benzamide

Systemtic Name: N-[3-(2-azanyl-6-methyl-4-oxidanylidene-1H-pyrimidin-5-yl)propyl]-4-(bromomethyl)benzamide Openeye Name: N-[3-(2-amino-6-methyl-4-oxo-1H-pyrimidin-5-yl)propyl]-4-(bromomethyl)benzamide CAS Name: N-[3-(2-amino-6-methyl-4-oxo-1H-pyrimidin-5-yl)propyl]-4-(bromomethyl)benzamide IUPAC Name: N-[3-(2-amino-6-methyl-4-oxo-1H-pyrimidin-5-yl)propyl]-4-(bromomethyl)benzamide Traditional Name: N-[3-(2-amino-4-keto-6-methyl-1H-pyrimidin-5-yl)propyl]-4-(bromomethyl)benzamide Formula: C16H19BrN4O2 MolecularWeight: 379.25166

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=O)N=C(N1)N)CCCNC(=O)C2=CC=C(C=C2)CBr

Isomeric SMILES

CC1=C(C(=O)N=C(N1)N)CCCNC(=O)C2=CC=C(C=C2)CBr

InChI

InChI=1S/C16H19BrN4O2/c1-10-13(15(23)21-16(18)20-10)3-2-8-19-14(22)12-6-4-11(9-17)5-7-12/h4-7H,2-3,8-9H2,1H3,(H,19,22)(H3,18,20,21,23)