2-chloranyl-N-[4-methylsulfanyl-1-oxidanylidene-1-[[1-(phenylmethyl)pyrrolidin-3-yl]amino]butan-2-yl]benzamide

Systemtic Name: 2-chloranyl-N-[4-methylsulfanyl-1-oxidanylidene-1-[[1-(phenylmethyl)pyrrolidin-3-yl]amino]butan-2-yl]benzamide Openeye Name: N-[1-[(1-benzylpyrrolidin-3-yl)carbamoyl]-3-methylsulfanyl-propyl]-2-chloro-benzamide CAS Name: 2-chloro-N-[4-(methylthio)-1-oxo-1-[[1-(phenylmethyl)-3-pyrrolidinyl]amino]butan-2-yl]benzamide IUPAC Name: N-[1-[(1-benzylpyrrolidin-3-yl)amino]-4-methylsulfanyl-1-oxobutan-2-yl]-2-chlorobenzamide Traditional Name: N-[1-[(1-benzylpyrrolidin-3-yl)carbamoyl]-3-(methylthio)propyl]-2-chloro-benzamide Formula: C23H28ClN3O2S MolecularWeight: 446.00532

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Descriptors Computed from Structure

Canonical SMILES:

CSCCC(C(=O)NC1CCN(C1)CC2=CC=CC=C2)NC(=O)C3=CC=CC=C3Cl

Isomeric SMILES

CSCCC(C(=O)NC1CCN(C1)CC2=CC=CC=C2)NC(=O)C3=CC=CC=C3Cl

InChI

InChI=1S/C23H28ClN3O2S/c1-30-14-12-21(26-22(28)19-9-5-6-10-20(19)24)23(29)25-18-11-13-27(16-18)15-17-7-3-2-4-8-17/h2-10,18,21H,11-16H2,1H3,(H,25,29)(H,26,28)