N-(6-methylsulfonyl-1,3-benzothiazol-2-yl)-1-[2-(naphthalen-1-ylamino)-2-oxidanylidene-ethyl]piperidine-4-carboxamide

Systemtic Name: N-(6-methylsulfonyl-1,3-benzothiazol-2-yl)-1-[2-(naphthalen-1-ylamino)-2-oxidanylidene-ethyl]piperidine-4-carboxamide Openeye Name: N-(6-methylsulfonyl-1,3-benzothiazol-2-yl)-1-[2-(1-naphthylamino)-2-oxo-ethyl]piperidine-4-carboxamide CAS Name: N-(6-methylsulfonyl-1,3-benzothiazol-2-yl)-1-[2-(1-naphthalenylamino)-2-oxoethyl]-4-piperidinecarboxamide IUPAC Name: N-(6-methylsulfonyl-1,3-benzothiazol-2-yl)-1-[2-(naphthalen-1-ylamino)-2-oxoethyl]piperidine-4-carboxamide Traditional Name: 1-[2-keto-2-(1-naphthylamino)ethyl]-N-(6-mesyl-1,3-benzothiazol-2-yl)isonipecotamide Formula: C26H26N4O4S2 MolecularWeight: 522.63904

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)C1=CC2=C(C=C1)N=C(S2)NC(=O)C3CCN(CC3)CC(=O)NC4=CC=CC5=CC=CC=C54

Isomeric SMILES

CS(=O)(=O)C1=CC2=C(C=C1)N=C(S2)NC(=O)C3CCN(CC3)CC(=O)NC4=CC=CC5=CC=CC=C54

InChI

InChI=1S/C26H26N4O4S2/c1-36(33,34)19-9-10-22-23(15-19)35-26(28-22)29-25(32)18-11-13-30(14-12-18)16-24(31)27-21-8-4-6-17-5-2-3-7-20(17)21/h2-10,15,18H,11-14,16H2,1H3,(H,27,31)(H,28,29,32)