2-(1-adamantyl)-N-[(6-morpholin-4-yl-1,3-benzothiazol-2-yl)carbamothioyl]ethanamide

Systemtic Name: 2-(1-adamantyl)-N-[(6-morpholin-4-yl-1,3-benzothiazol-2-yl)carbamothioyl]ethanamide Openeye Name: 2-(1-adamantyl)-N-[(6-morpholino-1,3-benzothiazol-2-yl)carbamothioyl]acetamide CAS Name: 2-(1-adamantyl)-N-[[[6-(4-morpholinyl)-1,3-benzothiazol-2-yl]amino]-sulfanylidenemethyl]acetamide IUPAC Name: 2-(1-adamantyl)-N-[(6-morpholin-4-yl-1,3-benzothiazol-2-yl)carbamothioyl]acetamide Traditional Name: 2-(1-adamantyl)-N-[(6-morpholino-1,3-benzothiazol-2-yl)thiocarbamoyl]acetamide Formula: C24H30N4O2S2 MolecularWeight: 470.6506

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Descriptors Computed from Structure

Canonical SMILES:

C1COCCN1C2=CC3=C(C=C2)N=C(S3)NC(=S)NC(=O)CC45CC6CC(C4)CC(C6)C5

Isomeric SMILES

C1COCCN1C2=CC3=C(C=C2)N=C(S3)NC(=S)NC(=O)CC45CC6CC(C4)CC(C6)C5

InChI

InChI=1S/C24H30N4O2S2/c29-21(14-24-11-15-7-16(12-24)9-17(8-15)13-24)26-22(31)27-23-25-19-2-1-18(10-20(19)32-23)28-3-5-30-6-4-28/h1-2,10,15-17H,3-9,11-14H2,(H2,25,26,27,29,31)