2-chloranyl-N-[1-[4-(2-methoxyphenyl)piperazin-1-yl]-4-methylsulfanyl-1-oxidanylidene-butan-2-yl]benzamide

Systemtic Name: 2-chloranyl-N-[1-[4-(2-methoxyphenyl)piperazin-1-yl]-4-methylsulfanyl-1-oxidanylidene-butan-2-yl]benzamide Openeye Name: 2-chloro-N-[1-[4-(2-methoxyphenyl)piperazine-1-carbonyl]-3-methylsulfanyl-propyl]benzamide CAS Name: 2-chloro-N-[1-[4-(2-methoxyphenyl)-1-piperazinyl]-4-(methylthio)-1-oxobutan-2-yl]benzamide IUPAC Name: 2-chloro-N-[1-[4-(2-methoxyphenyl)piperazin-1-yl]-4-methylsulfanyl-1-oxobutan-2-yl]benzamide Traditional Name: 2-chloro-N-[1-[4-(2-methoxyphenyl)piperazine-1-carbonyl]-3-(methylthio)propyl]benzamide Formula: C23H28ClN3O3S MolecularWeight: 462.00472

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC=C1N2CCN(CC2)C(=O)C(CCSC)NC(=O)C3=CC=CC=C3Cl

Isomeric SMILES

COC1=CC=CC=C1N2CCN(CC2)C(=O)C(CCSC)NC(=O)C3=CC=CC=C3Cl

InChI

InChI=1S/C23H28ClN3O3S/c1-30-21-10-6-5-9-20(21)26-12-14-27(15-13-26)23(29)19(11-16-31-2)25-22(28)17-7-3-4-8-18(17)24/h3-10,19H,11-16H2,1-2H3,(H,25,28)