3-[(6-chloranyl-1H-benzimidazol-2-yl)methyl]-1-(4-nitrophenyl)-4-thia-1-azaspiro[4.5]decan-2-one

Systemtic Name: 3-[(6-chloranyl-1H-benzimidazol-2-yl)methyl]-1-(4-nitrophenyl)-4-thia-1-azaspiro[4.5]decan-2-one Openeye Name: 3-[(6-chloro-1H-benzimidazol-2-yl)methyl]-1-(4-nitrophenyl)-4-thia-1-azaspiro[4.5]decan-2-one CAS Name: 3-[(6-chloro-1H-benzimidazol-2-yl)methyl]-1-(4-nitrophenyl)-4-thia-1-azaspiro[4.5]decan-2-one IUPAC Name: 3-[(6-chloro-1H-benzimidazol-2-yl)methyl]-1-(4-nitrophenyl)-4-thia-1-azaspiro[4.5]decan-2-one Traditional Name: 3-[(6-chloro-1H-benzimidazol-2-yl)methyl]-1-(4-nitrophenyl)-4-thia-1-azaspiro[4.5]decan-2-one Formula: C22H21ClN4O3S MolecularWeight: 456.94514

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC2(CC1)N(C(=O)C(S2)CC3=NC4=C(N3)C=C(C=C4)Cl)C5=CC=C(C=C5)[N+](=O)[O-]

Isomeric SMILES

C1CCC2(CC1)N(C(=O)C(S2)CC3=NC4=C(N3)C=C(C=C4)Cl)C5=CC=C(C=C5)[N+](=O)[O-]

InChI

InChI=1S/C22H21ClN4O3S/c23-14-4-9-17-18(12-14)25-20(24-17)13-19-21(28)26(22(31-19)10-2-1-3-11-22)15-5-7-16(8-6-15)27(29)30/h4-9,12,19H,1-3,10-11,13H2,(H,24,25)