N-(3-bromophenyl)-1-(2-methylphenyl)carbonyl-4-thia-1,8-diazaspiro[4.5]decane-8-carboxamide

Systemtic Name: N-(3-bromophenyl)-1-(2-methylphenyl)carbonyl-4-thia-1,8-diazaspiro[4.5]decane-8-carboxamide Openeye Name: N-(3-bromophenyl)-1-(2-methylbenzoyl)-4-thia-1,8-diazaspiro[4.5]decane-8-carboxamide CAS Name: N-(3-bromophenyl)-1-[(2-methylphenyl)-oxomethyl]-4-thia-1,8-diazaspiro[4.5]decane-8-carboxamide IUPAC Name: N-(3-bromophenyl)-1-(2-methylbenzoyl)-4-thia-1,8-diazaspiro[4.5]decane-8-carboxamide Traditional Name: N-(3-bromophenyl)-1-o-toluoyl-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=C1C(=O)N2CCSC23CCN(CC3)C(=O)NC4=CC(=CC=C4)Br

Isomeric SMILES

CC1=CC=CC=C1C(=O)N2CCSC23CCN(CC3)C(=O)NC4=CC(=CC=C4)Br

InChI

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