methyl N-methyl-N-[2-(3-methylbenzo[b][1]benzothiepin-5-yl)sulfanylethyl]carbamate

Systemtic Name: methyl N-methyl-N-[2-(3-methylbenzo[b][1]benzothiepin-5-yl)sulfanylethyl]carbamate Openeye Name: methyl N-methyl-N-[2-(3-methylbenzo[b][1]benzothiepin-5-yl)sulfanylethyl]carbamate CAS Name: N-methyl-N-[2-[(3-methyl-5-benzo[b][1]benzothiepinyl)thio]ethyl]carbamic acid methyl ester IUPAC Name: methyl N-methyl-N-[2-(3-methylbenzo[b][1]benzothiepin-5-yl)sulfanylethyl]carbamate Traditional Name: N-methyl-N-[2-[(3-methylbenzo[b][1]benzothiepin-5-yl)thio]ethyl]carbamic acid methyl ester Formula: C20H21NO2S2 MolecularWeight: 371.51624

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)SC3=CC=CC=C3C=C2SCCN(C)C(=O)OC

Isomeric SMILES

CC1=CC2=C(C=C1)SC3=CC=CC=C3C=C2SCCN(C)C(=O)OC

InChI

InChI=1S/C20H21NO2S2/c1-14-8-9-18-16(12-14)19(24-11-10-21(2)20(22)23-3)13-15-6-4-5-7-17(15)25-18/h4-9,12-13H,10-11H2,1-3H3