N-(2-azanylethyl)-4-bromanyl-N-[1-[5-cyclopropyl-6-oxidanylidene-1-(phenylmethyl)pyrimidin-2-yl]propyl]benzamide

Systemtic Name: N-(2-azanylethyl)-4-bromanyl-N-[1-[5-cyclopropyl-6-oxidanylidene-1-(phenylmethyl)pyrimidin-2-yl]propyl]benzamide Openeye Name: N-(2-aminoethyl)-N-[1-(1-benzyl-5-cyclopropyl-6-oxo-pyrimidin-2-yl)propyl]-4-bromo-benzamide CAS Name: N-(2-aminoethyl)-4-bromo-N-[1-[5-cyclopropyl-6-oxo-1-(phenylmethyl)-2-pyrimidinyl]propyl]benzamide IUPAC Name: N-(2-aminoethyl)-N-[1-(1-benzyl-5-cyclopropyl-6-oxopyrimidin-2-yl)propyl]-4-bromobenzamide Traditional Name: N-(2-aminoethyl)-N-[1-(1-benzyl-5-cyclopropyl-6-keto-pyrimidin-2-yl)propyl]-4-bromo-benzamide Formula: C26H29BrN4O2 MolecularWeight: 509.43806

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C1=NC=C(C(=O)N1CC2=CC=CC=C2)C3CC3)N(CCN)C(=O)C4=CC=C(C=C4)Br

Isomeric SMILES

CCC(C1=NC=C(C(=O)N1CC2=CC=CC=C2)C3CC3)N(CCN)C(=O)C4=CC=C(C=C4)Br

InChI

InChI=1S/C26H29BrN4O2/c1-2-23(30(15-14-28)25(32)20-10-12-21(27)13-11-20)24-29-16-22(19-8-9-19)26(33)31(24)17-18-6-4-3-5-7-18/h3-7,10-13,16,19,23H,2,8-9,14-15,17,28H2,1H3