N-[2-(3,4-dihydro-2H-thiochromen-4-ylamino)-2-oxidanylidene-ethyl]adamantane-1-carboxamide

Systemtic Name: N-[2-(3,4-dihydro-2H-thiochromen-4-ylamino)-2-oxidanylidene-ethyl]adamantane-1-carboxamide Openeye Name: N-[2-oxo-2-(thiochroman-4-ylamino)ethyl]adamantane-1-carboxamide CAS Name: N-[2-(3,4-dihydro-2H-1-benzothiopyran-4-ylamino)-2-oxoethyl]-1-adamantanecarboxamide IUPAC Name: N-[2-(3,4-dihydro-2H-thiochromen-4-ylamino)-2-oxoethyl]adamantane-1-carboxamide Traditional Name: N-[2-keto-2-(thiochroman-4-ylamino)ethyl]adamantane-1-carboxamide Formula: C22H28N2O2S MolecularWeight: 384.53492

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Descriptors Computed from Structure

Canonical SMILES:

C1CSC2=CC=CC=C2C1NC(=O)CNC(=O)C34CC5CC(C3)CC(C5)C4

Isomeric SMILES

C1CSC2=CC=CC=C2C1NC(=O)CNC(=O)C34CC5CC(C3)CC(C5)C4

InChI

InChI=1S/C22H28N2O2S/c25-20(24-18-5-6-27-19-4-2-1-3-17(18)19)13-23-21(26)22-10-14-7-15(11-22)9-16(8-14)12-22/h1-4,14-16,18H,5-13H2,(H,23,26)(H,24,25)