3-(3-chloranyl-6H-benzo[b][1,4]benzothiazepin-5-yl)-N-methyl-propan-1-amine

Systemtic Name: 3-(3-chloranyl-6H-benzo[b][1,4]benzothiazepin-5-yl)-N-methyl-propan-1-amine Openeye Name: 3-(3-chloro-6H-benzo[b][1,4]benzothiazepin-5-yl)-N-methyl-propan-1-amine CAS Name: 3-(3-chloro-6H-benzo[b][1,4]benzothiazepin-5-yl)-N-methyl-1-propanamine IUPAC Name: 3-(3-chloro-6H-benzo[b][1,4]benzothiazepin-5-yl)-N-methylpropan-1-amine Traditional Name: 3-(3-chloro-6H-benzo[b][1,4]benzothiazepin-5-yl)propyl-methyl-amine Formula: C17H19ClN2S MolecularWeight: 318.86416

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Descriptors Computed from Structure

Canonical SMILES:

CNCCCN1CC2=CC=CC=C2SC3=C1C=C(C=C3)Cl

Isomeric SMILES

CNCCCN1CC2=CC=CC=C2SC3=C1C=C(C=C3)Cl

InChI

InChI=1S/C17H19ClN2S/c1-19-9-4-10-20-12-13-5-2-3-6-16(13)21-17-8-7-14(18)11-15(17)20/h2-3,5-8,11,19H,4,9-10,12H2,1H3