N-(2-azanyl-2-oxidanylidene-ethyl)-3-[4-(4-fluorophenyl)piperazin-1-yl]sulfonyl-benzamide

Systemtic Name: N-(2-azanyl-2-oxidanylidene-ethyl)-3-[4-(4-fluorophenyl)piperazin-1-yl]sulfonyl-benzamide Openeye Name: N-(2-amino-2-oxo-ethyl)-3-[4-(4-fluorophenyl)piperazin-1-yl]sulfonyl-benzamide CAS Name: N-(2-amino-2-oxoethyl)-3-[[4-(4-fluorophenyl)-1-piperazinyl]sulfonyl]benzamide IUPAC Name: N-(2-amino-2-oxoethyl)-3-[4-(4-fluorophenyl)piperazin-1-yl]sulfonylbenzamide Traditional Name: N-(2-amino-2-keto-ethyl)-3-[4-(4-fluorophenyl)piperazino]sulfonyl-benzamide Formula: C19H21FN4O4S MolecularWeight: 420.457843

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=CC=C(C=C2)F)S(=O)(=O)C3=CC=CC(=C3)C(=O)NCC(=O)N

Isomeric SMILES

C1CN(CCN1C2=CC=C(C=C2)F)S(=O)(=O)C3=CC=CC(=C3)C(=O)NCC(=O)N

InChI

InChI=1S/C19H21FN4O4S/c20-15-4-6-16(7-5-15)23-8-10-24(11-9-23)29(27,28)17-3-1-2-14(12-17)19(26)22-13-18(21)25/h1-7,12H,8-11,13H2,(H2,21,25)(H,22,26)