N-[2-(azepan-1-yl)propyl]-4-[(propan-2-ylcarbamoylamino)methyl]benzamide

Systemtic Name: N-[2-(azepan-1-yl)propyl]-4-[(propan-2-ylcarbamoylamino)methyl]benzamide Openeye Name: N-[2-(azepan-1-yl)propyl]-4-[(isopropylcarbamoylamino)methyl]benzamide CAS Name: N-[2-(1-azepanyl)propyl]-4-[[[oxo-(propan-2-ylamino)methyl]amino]methyl]benzamide IUPAC Name: N-[2-(azepan-1-yl)propyl]-4-[(propan-2-ylcarbamoylamino)methyl]benzamide Traditional Name: N-[2-(azepan-1-yl)propyl]-4-[(isopropylcarbamoylamino)methyl]benzamide Formula: C21H34N4O2 MolecularWeight: 374.52026

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)NC(=O)NCC1=CC=C(C=C1)C(=O)NCC(C)N2CCCCCC2

Isomeric SMILES

CC(C)NC(=O)NCC1=CC=C(C=C1)C(=O)NCC(C)N2CCCCCC2

InChI

InChI=1S/C21H34N4O2/c1-16(2)24-21(27)23-15-18-8-10-19(11-9-18)20(26)22-14-17(3)25-12-6-4-5-7-13-25/h8-11,16-17H,4-7,12-15H2,1-3H3,(H,22,26)(H2,23,24,27)