3-[[1,1-bis(oxidanylidene)-3,4-dihydro-2H-thiochromen-4-yl]amino]azepan-2-one

Systemtic Name: 3-[[1,1-bis(oxidanylidene)-3,4-dihydro-2H-thiochromen-4-yl]amino]azepan-2-one Openeye Name: 3-[(1,1-dioxo-3,4-dihydro-2H-thiochromen-4-yl)amino]azepan-2-one CAS Name: 3-[(1,1-dioxo-3,4-dihydro-2H-1-benzothiopyran-4-yl)amino]-2-azepanone IUPAC Name: 3-[(1,1-dioxo-3,4-dihydro-2H-thiochromen-4-yl)amino]azepan-2-one Traditional Name: 3-[(1,1-diketo-3,4-dihydro-2H-thiochromen-4-yl)amino]azepan-2-one Formula: C15H20N2O3S MolecularWeight: 308.3959

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Descriptors Computed from Structure

Canonical SMILES:

C1CCNC(=O)C(C1)NC2CCS(=O)(=O)C3=CC=CC=C23

Isomeric SMILES

C1CCNC(=O)C(C1)NC2CCS(=O)(=O)C3=CC=CC=C23

InChI

InChI=1S/C15H20N2O3S/c18-15-13(6-3-4-9-16-15)17-12-8-10-21(19,20)14-7-2-1-5-11(12)14/h1-2,5,7,12-13,17H,3-4,6,8-10H2,(H,16,18)