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

Systemtic Name: 1-(3-nitrophenyl)carbonyl-N-phenyl-4-thia-1,8-diazaspiro[4.5]decane-8-carboxamide Openeye Name: 1-(3-nitrobenzoyl)-N-phenyl-4-thia-1,8-diazaspiro[4.5]decane-8-carboxamide CAS Name: 1-[(3-nitrophenyl)-oxomethyl]-N-phenyl-4-thia-1,8-diazaspiro[4.5]decane-8-carboxamide IUPAC Name: 1-(3-nitrobenzoyl)-N-phenyl-4-thia-1,8-diazaspiro[4.5]decane-8-carboxamide Traditional Name: 1-(3-nitrobenzoyl)-N-phenyl-4-thia-1,8-diazaspiro[4.5]decane-8-carboxamide Formula: C21H22N4O4S MolecularWeight: 426.48878

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC12N(CCS2)C(=O)C3=CC(=CC=C3)[N+](=O)[O-])C(=O)NC4=CC=CC=C4

Isomeric SMILES

C1CN(CCC12N(CCS2)C(=O)C3=CC(=CC=C3)[N+](=O)[O-])C(=O)NC4=CC=CC=C4

InChI

InChI=1S/C21H22N4O4S/c26-19(16-5-4-8-18(15-16)25(28)29)24-13-14-30-21(24)9-11-23(12-10-21)20(27)22-17-6-2-1-3-7-17/h1-8,15H,9-14H2,(H,22,27)