N-(1-adamantylcarbamoyl)-2-[[5-(2-azanyl-2-oxidanylidene-ethyl)-4-methyl-1,3-thiazol-2-yl]sulfanyl]propanamide

Systemtic Name: N-(1-adamantylcarbamoyl)-2-[[5-(2-azanyl-2-oxidanylidene-ethyl)-4-methyl-1,3-thiazol-2-yl]sulfanyl]propanamide Openeye Name: N-(1-adamantylcarbamoyl)-2-[5-(2-amino-2-oxo-ethyl)-4-methyl-thiazol-2-yl]sulfanyl-propanamide CAS Name: N-[(1-adamantylamino)-oxomethyl]-2-[[5-(2-amino-2-oxoethyl)-4-methyl-2-thiazolyl]thio]propanamide IUPAC Name: N-(1-adamantylcarbamoyl)-2-[[5-(2-amino-2-oxoethyl)-4-methyl-1,3-thiazol-2-yl]sulfanyl]propanamide Traditional Name: N-(1-adamantylcarbamoyl)-2-[[5-(2-amino-2-keto-ethyl)-4-methyl-thiazol-2-yl]thio]propionamide Formula: C20H28N4O3S2 MolecularWeight: 436.59132

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC(=N1)SC(C)C(=O)NC(=O)NC23CC4CC(C2)CC(C4)C3)CC(=O)N

Isomeric SMILES

CC1=C(SC(=N1)SC(C)C(=O)NC(=O)NC23CC4CC(C2)CC(C4)C3)CC(=O)N

InChI

InChI=1S/C20H28N4O3S2/c1-10-15(6-16(21)25)29-19(22-10)28-11(2)17(26)23-18(27)24-20-7-12-3-13(8-20)5-14(4-12)9-20/h11-14H,3-9H2,1-2H3,(H2,21,25)(H2,23,24,26,27)