5-[4-[(4-bromophenyl)methyl]piperazin-1-yl]-2-cyclopropyl-1,3-oxazole-4-carbonitrile

Systemtic Name: 5-[4-[(4-bromophenyl)methyl]piperazin-1-yl]-2-cyclopropyl-1,3-oxazole-4-carbonitrile Openeye Name: 5-[4-[(4-bromophenyl)methyl]piperazin-1-yl]-2-cyclopropyl-oxazole-4-carbonitrile CAS Name: 5-[4-[(4-bromophenyl)methyl]-1-piperazinyl]-2-cyclopropyl-4-oxazolecarbonitrile IUPAC Name: 5-[4-[(4-bromophenyl)methyl]piperazin-1-yl]-2-cyclopropyl-1,3-oxazole-4-carbonitrile Traditional Name: 5-[4-(4-bromobenzyl)piperazino]-2-cyclopropyl-oxazole-4-carbonitrile Formula: C18H19BrN4O MolecularWeight: 387.27366

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CC1C2=NC(=C(O2)N3CCN(CC3)CC4=CC=C(C=C4)Br)C#N

Isomeric SMILES

C1CC1C2=NC(=C(O2)N3CCN(CC3)CC4=CC=C(C=C4)Br)C#N

InChI

InChI=1S/C18H19BrN4O/c19-15-5-1-13(2-6-15)12-22-7-9-23(10-8-22)18-16(11-20)21-17(24-18)14-3-4-14/h1-2,5-6,14H,3-4,7-10,12H2