(8R,9S)-10-azanylidene-8-(3-bromophenyl)-7,11-dithiaspiro[5.5]undecane-9-carbonitrile

Systemtic Name: (8R,9S)-10-azanylidene-8-(3-bromophenyl)-7,11-dithiaspiro[5.5]undecane-9-carbonitrile Openeye Name: (8R,9S)-8-(3-bromophenyl)-10-imino-7,11-dithiaspiro[5.5]undecane-9-carbonitrile CAS Name: (8R,9S)-8-(3-bromophenyl)-10-imino-7,11-dithiaspiro[5.5]undecane-9-carbonitrile IUPAC Name: (8R,9S)-8-(3-bromophenyl)-10-imino-7,11-dithiaspiro[5.5]undecane-9-carbonitrile Traditional Name: (8R,9S)-8-(3-bromophenyl)-10-imino-7,11-dithiaspiro[5.5]undecane-9-carbonitrile Formula: C16H17BrN2S2 MolecularWeight: 381.35358

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC2(CC1)SC(C(C(=N)S2)C#N)C3=CC(=CC=C3)Br

Isomeric SMILES

C1CCC2(CC1)S[C@H]([C@@H](C(=N)S2)C#N)C3=CC(=CC=C3)Br

InChI

InChI=1S/C16H17BrN2S2/c17-12-6-4-5-11(9-12)14-13(10-18)15(19)21-16(20-14)7-2-1-3-8-16/h4-6,9,13-14,19H,1-3,7-8H2/t13-,14-/m0/s1