N-(2-diethylaminoethyl)-4-[6-[4-(2-diethylaminoethylcarbamoyl)phenyl]pyrimidin-4-yl]benzamide dihydrobromide

Systemtic Name: N-(2-diethylaminoethyl)-4-[6-[4-(2-diethylaminoethylcarbamoyl)phenyl]pyrimidin-4-yl]benzamide dihydrobromide Openeye Name: N-(2-diethylaminoethyl)-4-[6-[4-(2-diethylaminoethylcarbamoyl)phenyl]pyrimidin-4-yl]benzamide dihydrobromide CAS Name: N-(2-diethylaminoethyl)-4-[6-[4-[(2-diethylaminoethylamino)-oxomethyl]phenyl]-4-pyrimidinyl]benzamide dihydrobromide IUPAC Name: N-(2-diethylaminoethyl)-4-[6-[4-(2-diethylaminoethylcarbamoyl)phenyl]pyrimidin-4-yl]benzamide dihydrobromide Traditional Name: N-(2-diethylaminoethyl)-4-[6-[4-(2-diethylaminoethylcarbamoyl)phenyl]pyrimidin-4-yl]benzamide dihydrobromide Formula: C30H42Br2N6O2 MolecularWeight: 678.50148

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)CCNC(=O)C1=CC=C(C=C1)C2=CC(=NC=N2)C3=CC=C(C=C3)C(=O)NCCN(CC)CC.Br.Br

Isomeric SMILES

CCN(CC)CCNC(=O)C1=CC=C(C=C1)C2=CC(=NC=N2)C3=CC=C(C=C3)C(=O)NCCN(CC)CC.Br.Br

InChI

InChI=1S/C30H40N6O2.2BrH/c1-5-35(6-2)19-17-31-29(37)25-13-9-23(10-14-25)27-21-28(34-22-33-27)24-11-15-26(16-12-24)30(38)32-18-20-36(7-3)8-4;;/h9-16,21-22H,5-8,17-20H2,1-4H3,(H,31,37)(H,32,38);2*1H