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

Systemtic Name: 2-chloranyl-N-[1-[[1-(2-methylpropanoyl)piperidin-4-yl]amino]-4-methylsulfanyl-1-oxidanylidene-butan-2-yl]benzamide Openeye Name: 2-chloro-N-[1-[[1-(2-methylpropanoyl)-4-piperidyl]carbamoyl]-3-methylsulfanyl-propyl]benzamide CAS Name: 2-chloro-N-[1-[[1-(2-methyl-1-oxopropyl)-4-piperidinyl]amino]-4-(methylthio)-1-oxobutan-2-yl]benzamide IUPAC Name: 2-chloro-N-[1-[[1-(2-methylpropanoyl)piperidin-4-yl]amino]-4-methylsulfanyl-1-oxobutan-2-yl]benzamide Traditional Name: 2-chloro-N-[1-[(1-isobutyryl-4-piperidyl)carbamoyl]-3-(methylthio)propyl]benzamide Formula: C21H30ClN3O3S MolecularWeight: 439.9992

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(=O)N1CCC(CC1)NC(=O)C(CCSC)NC(=O)C2=CC=CC=C2Cl

Isomeric SMILES

CC(C)C(=O)N1CCC(CC1)NC(=O)C(CCSC)NC(=O)C2=CC=CC=C2Cl

InChI

InChI=1S/C21H30ClN3O3S/c1-14(2)21(28)25-11-8-15(9-12-25)23-20(27)18(10-13-29-3)24-19(26)16-6-4-5-7-17(16)22/h4-7,14-15,18H,8-13H2,1-3H3,(H,23,27)(H,24,26)