5-[(3-bromophenyl)carbamoylamino]-N-(2-diethylaminoethyl)-2-piperidin-1-yl-benzamide

Systemtic Name: 5-[(3-bromophenyl)carbamoylamino]-N-(2-diethylaminoethyl)-2-piperidin-1-yl-benzamide Openeye Name: 5-[(3-bromophenyl)carbamoylamino]-N-(2-diethylaminoethyl)-2-(1-piperidyl)benzamide CAS Name: 5-[[(3-bromoanilino)-oxomethyl]amino]-N-(2-diethylaminoethyl)-2-(1-piperidinyl)benzamide IUPAC Name: 5-[(3-bromophenyl)carbamoylamino]-N-(2-diethylaminoethyl)-2-piperidin-1-ylbenzamide Traditional Name: 5-[(3-bromophenyl)carbamoylamino]-N-(2-diethylaminoethyl)-2-piperidino-benzamide Formula: C25H34BrN5O2 MolecularWeight: 516.47376

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)CCNC(=O)C1=C(C=CC(=C1)NC(=O)NC2=CC(=CC=C2)Br)N3CCCCC3

Isomeric SMILES

CCN(CC)CCNC(=O)C1=C(C=CC(=C1)NC(=O)NC2=CC(=CC=C2)Br)N3CCCCC3

InChI

InChI=1S/C25H34BrN5O2/c1-3-30(4-2)16-13-27-24(32)22-18-21(11-12-23(22)31-14-6-5-7-15-31)29-25(33)28-20-10-8-9-19(26)17-20/h8-12,17-18H,3-7,13-16H2,1-2H3,(H,27,32)(H2,28,29,33)