6-bromanyl-4-[4-(phenylmethyl)piperazin-1-yl]quinazoline dihydrochloride

Systemtic Name: 6-bromanyl-4-[4-(phenylmethyl)piperazin-1-yl]quinazoline dihydrochloride Openeye Name: 4-(4-benzylpiperazin-1-yl)-6-bromo-quinazoline dihydrochloride CAS Name: 6-bromo-4-[4-(phenylmethyl)-1-piperazinyl]quinazoline dihydrochloride IUPAC Name: 4-(4-benzylpiperazin-1-yl)-6-bromoquinazoline dihydrochloride Traditional Name: 4-(4-benzylpiperazino)-6-bromo-quinazoline dihydrochloride Formula: C19H21BrCl2N4 MolecularWeight: 456.20684

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CC2=CC=CC=C2)C3=NC=NC4=C3C=C(C=C4)Br.Cl.Cl

Isomeric SMILES

C1CN(CCN1CC2=CC=CC=C2)C3=NC=NC4=C3C=C(C=C4)Br.Cl.Cl

InChI

InChI=1S/C19H19BrN4.2ClH/c20-16-6-7-18-17(12-16)19(22-14-21-18)24-10-8-23(9-11-24)13-15-4-2-1-3-5-15;;/h1-7,12,14H,8-11,13H2;2*1H