4-chloranyl-N-[3-(4-imidazol-1-ylbutylamino)-3-oxidanylidene-propyl]benzamide

Systemtic Name: 4-chloranyl-N-[3-(4-imidazol-1-ylbutylamino)-3-oxidanylidene-propyl]benzamide Openeye Name: 4-chloro-N-[3-(4-imidazol-1-ylbutylamino)-3-oxo-propyl]benzamide CAS Name: 4-chloro-N-[3-[4-(1-imidazolyl)butylamino]-3-oxopropyl]benzamide IUPAC Name: 4-chloro-N-[3-(4-imidazol-1-ylbutylamino)-3-oxopropyl]benzamide Traditional Name: 4-chloro-N-[3-(4-imidazol-1-ylbutylamino)-3-keto-propyl]benzamide Formula: C17H21ClN4O2 MolecularWeight: 348.82724

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C(=O)NCCC(=O)NCCCCN2C=CN=C2)Cl

Isomeric SMILES

C1=CC(=CC=C1C(=O)NCCC(=O)NCCCCN2C=CN=C2)Cl

InChI

InChI=1S/C17H21ClN4O2/c18-15-5-3-14(4-6-15)17(24)21-9-7-16(23)20-8-1-2-11-22-12-10-19-13-22/h3-6,10,12-13H,1-2,7-9,11H2,(H,20,23)(H,21,24)