7-(1,3-benzothiazol-2-ylsulfanyl)-3-methyl-6,9-bis(oxidanyl)-1,3,4,5-tetrahydro-1-benzazepin-2-one

Systemtic Name: 7-(1,3-benzothiazol-2-ylsulfanyl)-3-methyl-6,9-bis(oxidanyl)-1,3,4,5-tetrahydro-1-benzazepin-2-one Openeye Name: 7-(1,3-benzothiazol-2-ylsulfanyl)-6,9-dihydroxy-3-methyl-1,3,4,5-tetrahydro-1-benzazepin-2-one CAS Name: 7-(1,3-benzothiazol-2-ylthio)-6,9-dihydroxy-3-methyl-1,3,4,5-tetrahydro-1-benzazepin-2-one IUPAC Name: 7-(1,3-benzothiazol-2-ylsulfanyl)-6,9-dihydroxy-3-methyl-1,3,4,5-tetrahydro-1-benzazepin-2-one Traditional Name: 7-(1,3-benzothiazol-2-ylthio)-6,9-dihydroxy-3-methyl-1,3,4,5-tetrahydro-1-benzazepin-2-one Formula: C18H16N2O3S2 MolecularWeight: 372.46124

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCC2=C(C(=CC(=C2O)SC3=NC4=CC=CC=C4S3)O)NC1=O

Isomeric SMILES

CC1CCC2=C(C(=CC(=C2O)SC3=NC4=CC=CC=C4S3)O)NC1=O

InChI

InChI=1S/C18H16N2O3S2/c1-9-6-7-10-15(20-17(9)23)12(21)8-14(16(10)22)25-18-19-11-4-2-3-5-13(11)24-18/h2-5,8-9,21-22H,6-7H2,1H3,(H,20,23)