3-chloranyl-N-(phenylmethyl)-5,6-dihydrobenzo[b][1]benzothiepin-6-amine

Systemtic Name: 3-chloranyl-N-(phenylmethyl)-5,6-dihydrobenzo[b][1]benzothiepin-6-amine Openeye Name: N-benzyl-3-chloro-5,6-dihydrobenzo[b][1]benzothiepin-6-amine CAS Name: 3-chloro-N-(phenylmethyl)-5,6-dihydrobenzo[b][1]benzothiepin-6-amine IUPAC Name: N-benzyl-3-chloro-5,6-dihydrobenzo[b][1]benzothiepin-6-amine Traditional Name: benzyl-(3-chloro-5,6-dihydrobenzo[b][1]benzothiepin-6-yl)amine Formula: C21H18ClNS MolecularWeight: 351.89232

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Descriptors Computed from Structure

Canonical SMILES:

C1C(C2=CC=CC=C2SC3=C1C=C(C=C3)Cl)NCC4=CC=CC=C4

Isomeric SMILES

C1C(C2=CC=CC=C2SC3=C1C=C(C=C3)Cl)NCC4=CC=CC=C4

InChI

InChI=1S/C21H18ClNS/c22-17-10-11-20-16(12-17)13-19(18-8-4-5-9-21(18)24-20)23-14-15-6-2-1-3-7-15/h1-12,19,23H,13-14H2