N-(2-bromanyl-4-methyl-phenyl)-2-[4-[2-(butylamino)-2-oxidanylidene-ethyl]piperazin-1-yl]propanamide

Systemtic Name: N-(2-bromanyl-4-methyl-phenyl)-2-[4-[2-(butylamino)-2-oxidanylidene-ethyl]piperazin-1-yl]propanamide Openeye Name: N-(2-bromo-4-methyl-phenyl)-2-[4-[2-(butylamino)-2-oxo-ethyl]piperazin-1-yl]propanamide CAS Name: N-(2-bromo-4-methylphenyl)-2-[4-[2-(butylamino)-2-oxoethyl]-1-piperazinyl]propanamide IUPAC Name: N-(2-bromo-4-methylphenyl)-2-[4-[2-(butylamino)-2-oxoethyl]piperazin-1-yl]propanamide Traditional Name: N-(2-bromo-4-methyl-phenyl)-2-[4-[2-(butylamino)-2-keto-ethyl]piperazino]propionamide Formula: C20H31BrN4O2 MolecularWeight: 439.38974

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCNC(=O)CN1CCN(CC1)C(C)C(=O)NC2=C(C=C(C=C2)C)Br

Isomeric SMILES

CCCCNC(=O)CN1CCN(CC1)C(C)C(=O)NC2=C(C=C(C=C2)C)Br

InChI

InChI=1S/C20H31BrN4O2/c1-4-5-8-22-19(26)14-24-9-11-25(12-10-24)16(3)20(27)23-18-7-6-15(2)13-17(18)21/h6-7,13,16H,4-5,8-12,14H2,1-3H3,(H,22,26)(H,23,27)