N-(3-chloranyl-2-methyl-phenyl)-7,11-dioxa-3-azaspiro[5.5]undecane-3-carbothioamide

Systemtic Name: N-(3-chloranyl-2-methyl-phenyl)-7,11-dioxa-3-azaspiro[5.5]undecane-3-carbothioamide Openeye Name: N-(3-chloro-2-methyl-phenyl)-7,11-dioxa-3-azaspiro[5.5]undecane-3-carbothioamide CAS Name: N-(3-chloro-2-methylphenyl)-7,11-dioxa-3-azaspiro[5.5]undecane-3-carbothioamide IUPAC Name: N-(3-chloro-2-methylphenyl)-7,11-dioxa-3-azaspiro[5.5]undecane-3-carbothioamide Traditional Name: N-(3-chloro-2-methyl-phenyl)-7,11-dioxa-3-azaspiro[5.5]undecane-3-carbothioamide Formula: C16H21ClN2O2S MolecularWeight: 340.86814

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC=C1Cl)NC(=S)N2CCC3(CC2)OCCCO3

Isomeric SMILES

CC1=C(C=CC=C1Cl)NC(=S)N2CCC3(CC2)OCCCO3

InChI

InChI=1S/C16H21ClN2O2S/c1-12-13(17)4-2-5-14(12)18-15(22)19-8-6-16(7-9-19)20-10-3-11-21-16/h2,4-5H,3,6-11H2,1H3,(H,18,22)