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

Systemtic Name: 2-chloranyl-N-[1-[(1-cyclopropylcarbonylpiperidin-4-yl)amino]-4-methylsulfanyl-1-oxidanylidene-butan-2-yl]benzamide Openeye Name: 2-chloro-N-[1-[[1-(cyclopropanecarbonyl)-4-piperidyl]carbamoyl]-3-methylsulfanyl-propyl]benzamide CAS Name: 2-chloro-N-[1-[[1-[cyclopropyl(oxo)methyl]-4-piperidinyl]amino]-4-(methylthio)-1-oxobutan-2-yl]benzamide IUPAC Name: 2-chloro-N-[1-[[1-(cyclopropanecarbonyl)piperidin-4-yl]amino]-4-methylsulfanyl-1-oxobutan-2-yl]benzamide Traditional Name: 2-chloro-N-[1-[[1-(cyclopropanecarbonyl)-4-piperidyl]carbamoyl]-3-(methylthio)propyl]benzamide Formula: C21H28ClN3O3S MolecularWeight: 437.98332

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Descriptors Computed from Structure

Canonical SMILES:

CSCCC(C(=O)NC1CCN(CC1)C(=O)C2CC2)NC(=O)C3=CC=CC=C3Cl

Isomeric SMILES

CSCCC(C(=O)NC1CCN(CC1)C(=O)C2CC2)NC(=O)C3=CC=CC=C3Cl

InChI

InChI=1S/C21H28ClN3O3S/c1-29-13-10-18(24-19(26)16-4-2-3-5-17(16)22)20(27)23-15-8-11-25(12-9-15)21(28)14-6-7-14/h2-5,14-15,18H,6-13H2,1H3,(H,23,27)(H,24,26)