N-[3-[4-(phenylmethyl)piperazin-1-yl]propyl]-4-[(propan-2-ylcarbamoylamino)methyl]benzamide

Systemtic Name: N-[3-[4-(phenylmethyl)piperazin-1-yl]propyl]-4-[(propan-2-ylcarbamoylamino)methyl]benzamide Openeye Name: N-[3-(4-benzylpiperazin-1-yl)propyl]-4-[(isopropylcarbamoylamino)methyl]benzamide CAS Name: 4-[[[oxo-(propan-2-ylamino)methyl]amino]methyl]-N-[3-[4-(phenylmethyl)-1-piperazinyl]propyl]benzamide IUPAC Name: N-[3-(4-benzylpiperazin-1-yl)propyl]-4-[(propan-2-ylcarbamoylamino)methyl]benzamide Traditional Name: N-[3-(4-benzylpiperazino)propyl]-4-[(isopropylcarbamoylamino)methyl]benzamide Formula: C26H37N5O2 MolecularWeight: 451.60428

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)NC(=O)NCC1=CC=C(C=C1)C(=O)NCCCN2CCN(CC2)CC3=CC=CC=C3

Isomeric SMILES

CC(C)NC(=O)NCC1=CC=C(C=C1)C(=O)NCCCN2CCN(CC2)CC3=CC=CC=C3

InChI

InChI=1S/C26H37N5O2/c1-21(2)29-26(33)28-19-22-9-11-24(12-10-22)25(32)27-13-6-14-30-15-17-31(18-16-30)20-23-7-4-3-5-8-23/h3-5,7-12,21H,6,13-20H2,1-2H3,(H,27,32)(H2,28,29,33)