5-[(4-bromophenyl)carbamoylamino]-N-cyclopropyl-2-pyrrolidin-1-yl-benzamide

Systemtic Name: 5-[(4-bromophenyl)carbamoylamino]-N-cyclopropyl-2-pyrrolidin-1-yl-benzamide Openeye Name: 5-[(4-bromophenyl)carbamoylamino]-N-cyclopropyl-2-pyrrolidin-1-yl-benzamide CAS Name: 5-[[(4-bromoanilino)-oxomethyl]amino]-N-cyclopropyl-2-(1-pyrrolidinyl)benzamide IUPAC Name: 5-[(4-bromophenyl)carbamoylamino]-N-cyclopropyl-2-pyrrolidin-1-ylbenzamide Traditional Name: 5-[(4-bromophenyl)carbamoylamino]-N-cyclopropyl-2-pyrrolidino-benzamide Formula: C21H23BrN4O2 MolecularWeight: 443.33692

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)C2=C(C=C(C=C2)NC(=O)NC3=CC=C(C=C3)Br)C(=O)NC4CC4

Isomeric SMILES

C1CCN(C1)C2=C(C=C(C=C2)NC(=O)NC3=CC=C(C=C3)Br)C(=O)NC4CC4

InChI

InChI=1S/C21H23BrN4O2/c22-14-3-5-16(6-4-14)24-21(28)25-17-9-10-19(26-11-1-2-12-26)18(13-17)20(27)23-15-7-8-15/h3-6,9-10,13,15H,1-2,7-8,11-12H2,(H,23,27)(H2,24,25,28)