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

Systemtic Name: N-[1-[4-[2-(4-fluorophenyl)ethanoyl]piperazin-1-yl]-4-methylsulfanyl-1-oxidanylidene-butan-2-yl]-2-methoxy-benzamide Openeye Name: N-[1-[4-[2-(4-fluorophenyl)acetyl]piperazine-1-carbonyl]-3-methylsulfanyl-propyl]-2-methoxy-benzamide CAS Name: N-[1-[4-[2-(4-fluorophenyl)-1-oxoethyl]-1-piperazinyl]-4-(methylthio)-1-oxobutan-2-yl]-2-methoxybenzamide IUPAC Name: N-[1-[4-[2-(4-fluorophenyl)acetyl]piperazin-1-yl]-4-methylsulfanyl-1-oxobutan-2-yl]-2-methoxybenzamide Traditional Name: N-[1-[4-[2-(4-fluorophenyl)acetyl]piperazine-1-carbonyl]-3-(methylthio)propyl]-2-methoxy-benzamide Formula: C25H30FN3O4S MolecularWeight: 487.586803

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC=C1C(=O)NC(CCSC)C(=O)N2CCN(CC2)C(=O)CC3=CC=C(C=C3)F

Isomeric SMILES

COC1=CC=CC=C1C(=O)NC(CCSC)C(=O)N2CCN(CC2)C(=O)CC3=CC=C(C=C3)F

InChI

InChI=1S/C25H30FN3O4S/c1-33-22-6-4-3-5-20(22)24(31)27-21(11-16-34-2)25(32)29-14-12-28(13-15-29)23(30)17-18-7-9-19(26)10-8-18/h3-10,21H,11-17H2,1-2H3,(H,27,31)