4-chloranyl-N-[3-methyl-1-oxidanylidene-1-[(2-pyrrolidin-1-yl-2-thiophen-2-yl-ethyl)amino]butan-2-yl]benzamide

Systemtic Name: 4-chloranyl-N-[3-methyl-1-oxidanylidene-1-[(2-pyrrolidin-1-yl-2-thiophen-2-yl-ethyl)amino]butan-2-yl]benzamide Openeye Name: 4-chloro-N-[2-methyl-1-[[2-pyrrolidin-1-yl-2-(2-thienyl)ethyl]carbamoyl]propyl]benzamide CAS Name: 4-chloro-N-[3-methyl-1-oxo-1-[[2-(1-pyrrolidinyl)-2-thiophen-2-ylethyl]amino]butan-2-yl]benzamide IUPAC Name: 4-chloro-N-[3-methyl-1-oxo-1-[(2-pyrrolidin-1-yl-2-thiophen-2-ylethyl)amino]butan-2-yl]benzamide Traditional Name: 4-chloro-N-[2-methyl-1-[[2-pyrrolidino-2-(2-thienyl)ethyl]carbamoyl]propyl]benzamide Formula: C22H28ClN3O2S MolecularWeight: 433.99462

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C(=O)NCC(C1=CC=CS1)N2CCCC2)NC(=O)C3=CC=C(C=C3)Cl

Isomeric SMILES

CC(C)C(C(=O)NCC(C1=CC=CS1)N2CCCC2)NC(=O)C3=CC=C(C=C3)Cl

InChI

InChI=1S/C22H28ClN3O2S/c1-15(2)20(25-21(27)16-7-9-17(23)10-8-16)22(28)24-14-18(19-6-5-13-29-19)26-11-3-4-12-26/h5-10,13,15,18,20H,3-4,11-12,14H2,1-2H3,(H,24,28)(H,25,27)