N-[(E)-[1,1-bis(oxidanylidene)-2,3-dihydrothiochromen-4-ylidene]amino]-3-piperidin-1-ylsulfonyl-benzamide

Systemtic Name: N-[(E)-[1,1-bis(oxidanylidene)-2,3-dihydrothiochromen-4-ylidene]amino]-3-piperidin-1-ylsulfonyl-benzamide Openeye Name: N-[(E)-(1,1-dioxo-2,3-dihydrothiochromen-4-ylidene)amino]-3-(1-piperidylsulfonyl)benzamide CAS Name: N-[(E)-(1,1-dioxo-2,3-dihydro-1-benzothiopyran-4-ylidene)amino]-3-(1-piperidinylsulfonyl)benzamide IUPAC Name: N-[(E)-(1,1-dioxo-2,3-dihydrothiochromen-4-ylidene)amino]-3-piperidin-1-ylsulfonylbenzamide Traditional Name: N-[(E)-(1,1-diketo-2,3-dihydrothiochromen-4-ylidene)amino]-3-piperidinosulfonyl-benzamide Formula: C21H23N3O5S2 MolecularWeight: 461.55442

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)S(=O)(=O)C2=CC=CC(=C2)C(=O)NN=C3CCS(=O)(=O)C4=CC=CC=C34

Isomeric SMILES

C1CCN(CC1)S(=O)(=O)C2=CC=CC(=C2)C(=O)N/N=C/3\CCS(=O)(=O)C4=CC=CC=C34

InChI

InChI=1S/C21H23N3O5S2/c25-21(23-22-19-11-14-30(26,27)20-10-3-2-9-18(19)20)16-7-6-8-17(15-16)31(28,29)24-12-4-1-5-13-24/h2-3,6-10,15H,1,4-5,11-14H2,(H,23,25)/b22-19+