1-methyl-4-(3-methylsulfanyl-5,6-dihydrobenzo[b][1]benzothiepin-6-yl)piperazine

Systemtic Name: 1-methyl-4-(3-methylsulfanyl-5,6-dihydrobenzo[b][1]benzothiepin-6-yl)piperazine Openeye Name: 1-methyl-4-(3-methylsulfanyl-5,6-dihydrobenzo[b][1]benzothiepin-6-yl)piperazine CAS Name: 1-methyl-4-[3-(methylthio)-5,6-dihydrobenzo[b][1]benzothiepin-6-yl]piperazine IUPAC Name: 1-methyl-4-(3-methylsulfanyl-5,6-dihydrobenzo[b][1]benzothiepin-6-yl)piperazine Traditional Name: 1-methyl-4-[3-(methylthio)-5,6-dihydrobenzo[b][1]benzothiepin-6-yl]piperazine Formula: C20H24N2S2 MolecularWeight: 356.54796

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCN(CC1)C2CC3=C(C=CC(=C3)SC)SC4=CC=CC=C24

Isomeric SMILES

CN1CCN(CC1)C2CC3=C(C=CC(=C3)SC)SC4=CC=CC=C24

InChI

InChI=1S/C20H24N2S2/c1-21-9-11-22(12-10-21)18-14-15-13-16(23-2)7-8-19(15)24-20-6-4-3-5-17(18)20/h3-8,13,18H,9-12,14H2,1-2H3