N-[[3-(cyclobutylcarbonylamino)phenyl]methyl]-2-(2-oxidanylidene-2-pyrrolidin-1-yl-ethyl)sulfanyl-benzamide

Systemtic Name: N-[[3-(cyclobutylcarbonylamino)phenyl]methyl]-2-(2-oxidanylidene-2-pyrrolidin-1-yl-ethyl)sulfanyl-benzamide Openeye Name: N-[[3-(cyclobutanecarbonylamino)phenyl]methyl]-2-(2-oxo-2-pyrrolidin-1-yl-ethyl)sulfanyl-benzamide CAS Name: N-[[3-[[cyclobutyl(oxo)methyl]amino]phenyl]methyl]-2-[[2-oxo-2-(1-pyrrolidinyl)ethyl]thio]benzamide IUPAC Name: N-[[3-(cyclobutanecarbonylamino)phenyl]methyl]-2-(2-oxo-2-pyrrolidin-1-ylethyl)sulfanylbenzamide Traditional Name: N-[3-(cyclobutanecarbonylamino)benzyl]-2-[(2-keto-2-pyrrolidino-ethyl)thio]benzamide Formula: C25H29N3O3S MolecularWeight: 451.58106

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)C(=O)CSC2=CC=CC=C2C(=O)NCC3=CC(=CC=C3)NC(=O)C4CCC4

Isomeric SMILES

C1CCN(C1)C(=O)CSC2=CC=CC=C2C(=O)NCC3=CC(=CC=C3)NC(=O)C4CCC4

InChI

InChI=1S/C25H29N3O3S/c29-23(28-13-3-4-14-28)17-32-22-12-2-1-11-21(22)25(31)26-16-18-7-5-10-20(15-18)27-24(30)19-8-6-9-19/h1-2,5,7,10-12,15,19H,3-4,6,8-9,13-14,16-17H2,(H,26,31)(H,27,30)