N-[1-[4-[(2-fluorophenyl)methyl]piperazin-1-yl]-4-methylsulfanyl-1-oxidanylidene-butan-2-yl]-2-methoxy-benzamide

Systemtic Name: N-[1-[4-[(2-fluorophenyl)methyl]piperazin-1-yl]-4-methylsulfanyl-1-oxidanylidene-butan-2-yl]-2-methoxy-benzamide Openeye Name: N-[1-[4-[(2-fluorophenyl)methyl]piperazine-1-carbonyl]-3-methylsulfanyl-propyl]-2-methoxy-benzamide CAS Name: N-[1-[4-[(2-fluorophenyl)methyl]-1-piperazinyl]-4-(methylthio)-1-oxobutan-2-yl]-2-methoxybenzamide IUPAC Name: N-[1-[4-[(2-fluorophenyl)methyl]piperazin-1-yl]-4-methylsulfanyl-1-oxobutan-2-yl]-2-methoxybenzamide Traditional Name: N-[1-[4-(2-fluorobenzyl)piperazine-1-carbonyl]-3-(methylthio)propyl]-2-methoxy-benzamide Formula: C24H30FN3O3S MolecularWeight: 459.576703

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC=C1C(=O)NC(CCSC)C(=O)N2CCN(CC2)CC3=CC=CC=C3F

Isomeric SMILES

COC1=CC=CC=C1C(=O)NC(CCSC)C(=O)N2CCN(CC2)CC3=CC=CC=C3F

InChI

InChI=1S/C24H30FN3O3S/c1-31-22-10-6-4-8-19(22)23(29)26-21(11-16-32-2)24(30)28-14-12-27(13-15-28)17-18-7-3-5-9-20(18)25/h3-10,21H,11-17H2,1-2H3,(H,26,29)