3-chloranyl-6-[3-(dimethylamino)-2-methyl-propyl]-6H-benzo[b][1]benzothiepin-5-one

Systemtic Name: 3-chloranyl-6-[3-(dimethylamino)-2-methyl-propyl]-6H-benzo[b][1]benzothiepin-5-one Openeye Name: 3-chloro-6-[3-(dimethylamino)-2-methyl-propyl]-6H-benzo[b][1]benzothiepin-5-one CAS Name: 3-chloro-6-[3-(dimethylamino)-2-methylpropyl]-6H-benzo[b][1]benzothiepin-5-one IUPAC Name: 3-chloro-6-[3-(dimethylamino)-2-methylpropyl]-6H-benzo[b][1]benzothiepin-5-one Traditional Name: 3-chloro-6-[3-(dimethylamino)-2-methyl-propyl]-6H-benzo[b][1]benzothiepin-5-one Formula: C20H22ClNOS MolecularWeight: 359.91278

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Descriptors Computed from Structure

Canonical SMILES:

CC(CC1C2=CC=CC=C2SC3=C(C1=O)C=C(C=C3)Cl)CN(C)C

Isomeric SMILES

CC(CC1C2=CC=CC=C2SC3=C(C1=O)C=C(C=C3)Cl)CN(C)C

InChI

InChI=1S/C20H22ClNOS/c1-13(12-22(2)3)10-16-15-6-4-5-7-18(15)24-19-9-8-14(21)11-17(19)20(16)23/h4-9,11,13,16H,10,12H2,1-3H3