N-(1-adamantylmethyl)-2-chloranyl-5-(2-dimethylaminoethylsulfanyl)benzamide

Systemtic Name: N-(1-adamantylmethyl)-2-chloranyl-5-(2-dimethylaminoethylsulfanyl)benzamide Openeye Name: N-(1-adamantylmethyl)-2-chloro-5-(2-dimethylaminoethylsulfanyl)benzamide CAS Name: N-(1-adamantylmethyl)-2-chloro-5-(2-dimethylaminoethylthio)benzamide IUPAC Name: N-(1-adamantylmethyl)-2-chloro-5-(2-dimethylaminoethylsulfanyl)benzamide Traditional Name: N-(1-adamantylmethyl)-2-chloro-5-(2-dimethylaminoethylthio)benzamide Formula: C22H31ClN2OS MolecularWeight: 407.01234

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)CCSC1=CC(=C(C=C1)Cl)C(=O)NCC23CC4CC(C2)CC(C4)C3

Isomeric SMILES

CN(C)CCSC1=CC(=C(C=C1)Cl)C(=O)NCC23CC4CC(C2)CC(C4)C3

InChI

InChI=1S/C22H31ClN2OS/c1-25(2)5-6-27-18-3-4-20(23)19(10-18)21(26)24-14-22-11-15-7-16(12-22)9-17(8-15)13-22/h3-4,10,15-17H,5-9,11-14H2,1-2H3,(H,24,26)