4-[2-[(4-bromophenyl)carbamoylamino]-3-(1H-indol-3-yl)propanoyl]-N-ethyl-2-methyl-piperazine-1-carboxamide

Systemtic Name: 4-[2-[(4-bromophenyl)carbamoylamino]-3-(1H-indol-3-yl)propanoyl]-N-ethyl-2-methyl-piperazine-1-carboxamide Openeye Name: 4-[2-[(4-bromophenyl)carbamoylamino]-3-(1H-indol-3-yl)propanoyl]-N-ethyl-2-methyl-piperazine-1-carboxamide CAS Name: 4-[2-[[(4-bromoanilino)-oxomethyl]amino]-3-(1H-indol-3-yl)-1-oxopropyl]-N-ethyl-2-methyl-1-piperazinecarboxamide IUPAC Name: 4-[2-[(4-bromophenyl)carbamoylamino]-3-(1H-indol-3-yl)propanoyl]-N-ethyl-2-methylpiperazine-1-carboxamide Traditional Name: 4-[2-[(4-bromophenyl)carbamoylamino]-3-(1H-indol-3-yl)propanoyl]-N-ethyl-2-methyl-piperazine-1-carboxamide Formula: C26H31BrN6O3 MolecularWeight: 555.46674

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Descriptors Computed from Structure

Canonical SMILES:

CCNC(=O)N1CCN(CC1C)C(=O)C(CC2=CNC3=CC=CC=C32)NC(=O)NC4=CC=C(C=C4)Br

Isomeric SMILES

CCNC(=O)N1CCN(CC1C)C(=O)C(CC2=CNC3=CC=CC=C32)NC(=O)NC4=CC=C(C=C4)Br

InChI

InChI=1S/C26H31BrN6O3/c1-3-28-26(36)33-13-12-32(16-17(33)2)24(34)23(14-18-15-29-22-7-5-4-6-21(18)22)31-25(35)30-20-10-8-19(27)9-11-20/h4-11,15,17,23,29H,3,12-14,16H2,1-2H3,(H,28,36)(H2,30,31,35)