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

Systemtic Name: 2-chloranyl-N-[4-methylsulfanyl-1-oxidanylidene-1-[(2-pyrrolidin-1-yl-2-thiophen-2-yl-ethyl)amino]butan-2-yl]benzamide Openeye Name: 2-chloro-N-[3-methylsulfanyl-1-[[2-pyrrolidin-1-yl-2-(2-thienyl)ethyl]carbamoyl]propyl]benzamide CAS Name: 2-chloro-N-[4-(methylthio)-1-oxo-1-[[2-(1-pyrrolidinyl)-2-thiophen-2-ylethyl]amino]butan-2-yl]benzamide IUPAC Name: 2-chloro-N-[4-methylsulfanyl-1-oxo-1-[(2-pyrrolidin-1-yl-2-thiophen-2-ylethyl)amino]butan-2-yl]benzamide Traditional Name: 2-chloro-N-[3-(methylthio)-1-[[2-pyrrolidino-2-(2-thienyl)ethyl]carbamoyl]propyl]benzamide Formula: C22H28ClN3O2S2 MolecularWeight: 466.05962

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Descriptors Computed from Structure

Canonical SMILES:

CSCCC(C(=O)NCC(C1=CC=CS1)N2CCCC2)NC(=O)C3=CC=CC=C3Cl

Isomeric SMILES

CSCCC(C(=O)NCC(C1=CC=CS1)N2CCCC2)NC(=O)C3=CC=CC=C3Cl

InChI

InChI=1S/C22H28ClN3O2S2/c1-29-14-10-18(25-21(27)16-7-2-3-8-17(16)23)22(28)24-15-19(20-9-6-13-30-20)26-11-4-5-12-26/h2-3,6-9,13,18-19H,4-5,10-12,14-15H2,1H3,(H,24,28)(H,25,27)