3-[(6-chloranyl-3,4-dihydro-2H-thiochromen-4-yl)amino]azepan-2-one

Systemtic Name: 3-[(6-chloranyl-3,4-dihydro-2H-thiochromen-4-yl)amino]azepan-2-one Openeye Name: 3-[(6-chlorothiochroman-4-yl)amino]azepan-2-one CAS Name: 3-[(6-chloro-3,4-dihydro-2H-1-benzothiopyran-4-yl)amino]-2-azepanone IUPAC Name: 3-[(6-chloro-3,4-dihydro-2H-thiochromen-4-yl)amino]azepan-2-one Traditional Name: 3-[(6-chlorothiochroman-4-yl)amino]azepan-2-one Formula: C15H19ClN2OS MolecularWeight: 310.84216

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Descriptors Computed from Structure

Canonical SMILES:

C1CCNC(=O)C(C1)NC2CCSC3=C2C=C(C=C3)Cl

Isomeric SMILES

C1CCNC(=O)C(C1)NC2CCSC3=C2C=C(C=C3)Cl

InChI

InChI=1S/C15H19ClN2OS/c16-10-4-5-14-11(9-10)12(6-8-20-14)18-13-3-1-2-7-17-15(13)19/h4-5,9,12-13,18H,1-3,6-8H2,(H,17,19)