N-[2-[(2-bromophenyl)amino]-2-oxidanylidene-ethyl]-4-piperidin-1-ylsulfonyl-benzamide

Systemtic Name: N-[2-[(2-bromophenyl)amino]-2-oxidanylidene-ethyl]-4-piperidin-1-ylsulfonyl-benzamide Openeye Name: N-[2-(2-bromoanilino)-2-oxo-ethyl]-4-(1-piperidylsulfonyl)benzamide CAS Name: N-[2-(2-bromoanilino)-2-oxoethyl]-4-(1-piperidinylsulfonyl)benzamide IUPAC Name: N-[2-(2-bromoanilino)-2-oxoethyl]-4-piperidin-1-ylsulfonylbenzamide Traditional Name: N-[2-(2-bromoanilino)-2-keto-ethyl]-4-piperidinosulfonyl-benzamide Formula: C20H22BrN3O4S MolecularWeight: 480.37538

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)S(=O)(=O)C2=CC=C(C=C2)C(=O)NCC(=O)NC3=CC=CC=C3Br

Isomeric SMILES

C1CCN(CC1)S(=O)(=O)C2=CC=C(C=C2)C(=O)NCC(=O)NC3=CC=CC=C3Br

InChI

InChI=1S/C20H22BrN3O4S/c21-17-6-2-3-7-18(17)23-19(25)14-22-20(26)15-8-10-16(11-9-15)29(27,28)24-12-4-1-5-13-24/h2-3,6-11H,1,4-5,12-14H2,(H,22,26)(H,23,25)