3-(1-adamantylcarbamoylamino)-N-[1-(1,3-benzothiazol-2-yl)ethyl]-N-methyl-propanamide

Systemtic Name: 3-(1-adamantylcarbamoylamino)-N-[1-(1,3-benzothiazol-2-yl)ethyl]-N-methyl-propanamide Openeye Name: 3-(1-adamantylcarbamoylamino)-N-[1-(1,3-benzothiazol-2-yl)ethyl]-N-methyl-propanamide CAS Name: 3-[[(1-adamantylamino)-oxomethyl]amino]-N-[1-(1,3-benzothiazol-2-yl)ethyl]-N-methylpropanamide IUPAC Name: 3-(1-adamantylcarbamoylamino)-N-[1-(1,3-benzothiazol-2-yl)ethyl]-N-methylpropanamide Traditional Name: 3-(1-adamantylcarbamoylamino)-N-[1-(1,3-benzothiazol-2-yl)ethyl]-N-methyl-propionamide Formula: C24H32N4O2S MolecularWeight: 440.60148

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=NC2=CC=CC=C2S1)N(C)C(=O)CCNC(=O)NC34CC5CC(C3)CC(C5)C4

Isomeric SMILES

CC(C1=NC2=CC=CC=C2S1)N(C)C(=O)CCNC(=O)NC34CC5CC(C3)CC(C5)C4

InChI

InChI=1S/C24H32N4O2S/c1-15(22-26-19-5-3-4-6-20(19)31-22)28(2)21(29)7-8-25-23(30)27-24-12-16-9-17(13-24)11-18(10-16)14-24/h3-6,15-18H,7-14H2,1-2H3,(H2,25,27,30)