4-[[3-methylbutyl-[(5-methylthiophen-2-yl)methyl]amino]methyl]-N-(pyridin-3-ylmethyl)benzamide

Systemtic Name: 4-[[3-methylbutyl-[(5-methylthiophen-2-yl)methyl]amino]methyl]-N-(pyridin-3-ylmethyl)benzamide Openeye Name: 4-[[isopentyl-[(5-methyl-2-thienyl)methyl]amino]methyl]-N-(3-pyridylmethyl)benzamide CAS Name: 4-[[3-methylbutyl-[(5-methyl-2-thiophenyl)methyl]amino]methyl]-N-(3-pyridinylmethyl)benzamide IUPAC Name: 4-[[3-methylbutyl-[(5-methylthiophen-2-yl)methyl]amino]methyl]-N-(pyridin-3-ylmethyl)benzamide Traditional Name: 4-[[isoamyl-[(5-methyl-2-thienyl)methyl]amino]methyl]-N-(3-pyridylmethyl)benzamide Formula: C25H31N3OS MolecularWeight: 421.59814

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(S1)CN(CCC(C)C)CC2=CC=C(C=C2)C(=O)NCC3=CN=CC=C3

Isomeric SMILES

CC1=CC=C(S1)CN(CCC(C)C)CC2=CC=C(C=C2)C(=O)NCC3=CN=CC=C3

InChI

InChI=1S/C25H31N3OS/c1-19(2)12-14-28(18-24-11-6-20(3)30-24)17-21-7-9-23(10-8-21)25(29)27-16-22-5-4-13-26-15-22/h4-11,13,15,19H,12,14,16-18H2,1-3H3,(H,27,29)