3-(3-chloranyl-6-methyl-benzo[b][1]benzothiepin-5-yl)-N,N-dimethyl-prop-2-yn-1-amine

Systemtic Name: 3-(3-chloranyl-6-methyl-benzo[b][1]benzothiepin-5-yl)-N,N-dimethyl-prop-2-yn-1-amine Openeye Name: 3-(3-chloro-6-methyl-benzo[b][1]benzothiepin-5-yl)-N,N-dimethyl-prop-2-yn-1-amine CAS Name: 3-(3-chloro-6-methyl-5-benzo[b][1]benzothiepinyl)-N,N-dimethyl-2-propyn-1-amine IUPAC Name: 3-(3-chloro-6-methylbenzo[b][1]benzothiepin-5-yl)-N,N-dimethylprop-2-yn-1-amine Traditional Name: 3-(3-chloro-6-methyl-benzo[b][1]benzothiepin-5-yl)prop-2-ynyl-dimethyl-amine Formula: C20H18ClNS MolecularWeight: 339.88162

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C2=C(C=CC(=C2)Cl)SC3=CC=CC=C13)C#CCN(C)C

Isomeric SMILES

CC1=C(C2=C(C=CC(=C2)Cl)SC3=CC=CC=C13)C#CCN(C)C

InChI

InChI=1S/C20H18ClNS/c1-14-16(8-6-12-22(2)3)18-13-15(21)10-11-20(18)23-19-9-5-4-7-17(14)19/h4-5,7,9-11,13H,12H2,1-3H3