N-[(4-butan-2-ylphenyl)-thiophen-2-yl-methyl]-4-[(2-oxidanylidenepyrrolidin-1-yl)methyl]benzamide

Systemtic Name: N-[(4-butan-2-ylphenyl)-thiophen-2-yl-methyl]-4-[(2-oxidanylidenepyrrolidin-1-yl)methyl]benzamide Openeye Name: 4-[(2-oxopyrrolidin-1-yl)methyl]-N-[(4-sec-butylphenyl)-(2-thienyl)methyl]benzamide CAS Name: N-[(4-butan-2-ylphenyl)-thiophen-2-ylmethyl]-4-[(2-oxo-1-pyrrolidinyl)methyl]benzamide IUPAC Name: N-[(4-butan-2-ylphenyl)-thiophen-2-ylmethyl]-4-[(2-oxopyrrolidin-1-yl)methyl]benzamide Traditional Name: 4-[(2-ketopyrrolidino)methyl]-N-[(4-sec-butylphenyl)-(2-thienyl)methyl]benzamide Formula: C27H30N2O2S MolecularWeight: 446.6043

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC(C)C1=CC=C(C=C1)C(C2=CC=CS2)NC(=O)C3=CC=C(C=C3)CN4CCCC4=O

Isomeric SMILES

CCC(C)C1=CC=C(C=C1)C(C2=CC=CS2)NC(=O)C3=CC=C(C=C3)CN4CCCC4=O

InChI

InChI=1S/C27H30N2O2S/c1-3-19(2)21-12-14-22(15-13-21)26(24-6-5-17-32-24)28-27(31)23-10-8-20(9-11-23)18-29-16-4-7-25(29)30/h5-6,8-15,17,19,26H,3-4,7,16,18H2,1-2H3,(H,28,31)