4-(2-methylpropanoylamino)-N-(2-pyrrolidin-1-yl-2-thiophen-2-yl-ethyl)benzamide

Systemtic Name: 4-(2-methylpropanoylamino)-N-(2-pyrrolidin-1-yl-2-thiophen-2-yl-ethyl)benzamide Openeye Name: 4-(2-methylpropanoylamino)-N-[2-pyrrolidin-1-yl-2-(2-thienyl)ethyl]benzamide CAS Name: 4-[(2-methyl-1-oxopropyl)amino]-N-[2-(1-pyrrolidinyl)-2-thiophen-2-ylethyl]benzamide IUPAC Name: 4-(2-methylpropanoylamino)-N-(2-pyrrolidin-1-yl-2-thiophen-2-ylethyl)benzamide Traditional Name: 4-(isobutyrylamino)-N-[2-pyrrolidino-2-(2-thienyl)ethyl]benzamide Formula: C21H27N3O2S MolecularWeight: 385.52298

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(=O)NC1=CC=C(C=C1)C(=O)NCC(C2=CC=CS2)N3CCCC3

Isomeric SMILES

CC(C)C(=O)NC1=CC=C(C=C1)C(=O)NCC(C2=CC=CS2)N3CCCC3

InChI

InChI=1S/C21H27N3O2S/c1-15(2)20(25)23-17-9-7-16(8-10-17)21(26)22-14-18(19-6-5-13-27-19)24-11-3-4-12-24/h5-10,13,15,18H,3-4,11-12,14H2,1-2H3,(H,22,26)(H,23,25)