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

Systemtic Name: N-(3-bromophenyl)-1-(3-phenylprop-2-enoyl)-4-thia-1,8-diazaspiro[4.5]decane-8-carboxamide Openeye Name: N-(3-bromophenyl)-1-(3-phenylprop-2-enoyl)-4-thia-1,8-diazaspiro[4.5]decane-8-carboxamide CAS Name: N-(3-bromophenyl)-1-(1-oxo-3-phenylprop-2-enyl)-4-thia-1,8-diazaspiro[4.5]decane-8-carboxamide IUPAC Name: N-(3-bromophenyl)-1-(3-phenylprop-2-enoyl)-4-thia-1,8-diazaspiro[4.5]decane-8-carboxamide Traditional Name: N-(3-bromophenyl)-1-cinnamoyl-4-thia-1,8-diazaspiro[4.5]decane-8-carboxamide Formula: C23H24BrN3O2S MolecularWeight: 486.42456

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC12N(CCS2)C(=O)C=CC3=CC=CC=C3)C(=O)NC4=CC(=CC=C4)Br

Isomeric SMILES

C1CN(CCC12N(CCS2)C(=O)C=CC3=CC=CC=C3)C(=O)NC4=CC(=CC=C4)Br

InChI

InChI=1S/C23H24BrN3O2S/c24-19-7-4-8-20(17-19)25-22(29)26-13-11-23(12-14-26)27(15-16-30-23)21(28)10-9-18-5-2-1-3-6-18/h1-10,17H,11-16H2,(H,25,29)