6-(4-methylsulfanylphenyl)-8,9,10,11-tetrahydro-6H-benzo[c][1,5]benzothiazepin-7-one

Systemtic Name: 6-(4-methylsulfanylphenyl)-8,9,10,11-tetrahydro-6H-benzo[c][1,5]benzothiazepin-7-one Openeye Name: 6-(4-methylsulfanylphenyl)-8,9,10,11-tetrahydro-6H-benzo[c][1,5]benzothiazepin-7-one CAS Name: 6-[4-(methylthio)phenyl]-8,9,10,11-tetrahydro-6H-benzo[c][1,5]benzothiazepin-7-one IUPAC Name: 6-(4-methylsulfanylphenyl)-8,9,10,11-tetrahydro-6H-benzo[c][1,5]benzothiazepin-7-one Traditional Name: 6-[4-(methylthio)phenyl]-8,9,10,11-tetrahydro-6H-benzo[c][1,5]benzothiazepin-7-one Formula: C20H19NOS2 MolecularWeight: 353.50096

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=CC=C(C=C1)C2C3=C(CCCC3=O)NC4=CC=CC=C4S2

Isomeric SMILES

CSC1=CC=C(C=C1)C2C3=C(CCCC3=O)NC4=CC=CC=C4S2

InChI

InChI=1S/C20H19NOS2/c1-23-14-11-9-13(10-12-14)20-19-16(6-4-7-17(19)22)21-15-5-2-3-8-18(15)24-20/h2-3,5,8-12,20-21H,4,6-7H2,1H3