1-(3-bromophenyl)carbonyl-N-(3-methylphenyl)-4-thia-1,8-diazaspiro[4.5]decane-8-carboxamide

Systemtic Name: 1-(3-bromophenyl)carbonyl-N-(3-methylphenyl)-4-thia-1,8-diazaspiro[4.5]decane-8-carboxamide Openeye Name: 1-(3-bromobenzoyl)-N-(m-tolyl)-4-thia-1,8-diazaspiro[4.5]decane-8-carboxamide CAS Name: 1-[(3-bromophenyl)-oxomethyl]-N-(3-methylphenyl)-4-thia-1,8-diazaspiro[4.5]decane-8-carboxamide IUPAC Name: 1-(3-bromobenzoyl)-N-(3-methylphenyl)-4-thia-1,8-diazaspiro[4.5]decane-8-carboxamide Traditional Name: 1-(3-bromobenzoyl)-N-(m-tolyl)-4-thia-1,8-diazaspiro[4.5]decane-8-carboxamide Formula: C22H24BrN3O2S MolecularWeight: 474.41386

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)NC(=O)N2CCC3(CC2)N(CCS3)C(=O)C4=CC(=CC=C4)Br

Isomeric SMILES

CC1=CC(=CC=C1)NC(=O)N2CCC3(CC2)N(CCS3)C(=O)C4=CC(=CC=C4)Br

InChI

InChI=1S/C22H24BrN3O2S/c1-16-4-2-7-19(14-16)24-21(28)25-10-8-22(9-11-25)26(12-13-29-22)20(27)17-5-3-6-18(23)15-17/h2-7,14-15H,8-13H2,1H3,(H,24,28)