N-[1-[[4-(1-adamantyl)-1,3-thiazol-2-yl]amino]-4-methylsulfanyl-1-oxidanylidene-butan-2-yl]benzamide

Systemtic Name: N-[1-[[4-(1-adamantyl)-1,3-thiazol-2-yl]amino]-4-methylsulfanyl-1-oxidanylidene-butan-2-yl]benzamide Openeye Name: N-[1-[[4-(1-adamantyl)thiazol-2-yl]carbamoyl]-3-methylsulfanyl-propyl]benzamide CAS Name: N-[1-[[4-(1-adamantyl)-2-thiazolyl]amino]-4-(methylthio)-1-oxobutan-2-yl]benzamide IUPAC Name: N-[1-[[4-(1-adamantyl)-1,3-thiazol-2-yl]amino]-4-methylsulfanyl-1-oxobutan-2-yl]benzamide Traditional Name: N-[1-[[4-(1-adamantyl)thiazol-2-yl]carbamoyl]-3-(methylthio)propyl]benzamide Formula: C25H31N3O2S2 MolecularWeight: 469.66254

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Descriptors Computed from Structure

Canonical SMILES:

CSCCC(C(=O)NC1=NC(=CS1)C23CC4CC(C2)CC(C4)C3)NC(=O)C5=CC=CC=C5

Isomeric SMILES

CSCCC(C(=O)NC1=NC(=CS1)C23CC4CC(C2)CC(C4)C3)NC(=O)C5=CC=CC=C5

InChI

InChI=1S/C25H31N3O2S2/c1-31-8-7-20(26-22(29)19-5-3-2-4-6-19)23(30)28-24-27-21(15-32-24)25-12-16-9-17(13-25)11-18(10-16)14-25/h2-6,15-18,20H,7-14H2,1H3,(H,26,29)(H,27,28,30)