N-[1-[[4-(1-adamantylmethyl)-1,3-thiazol-2-yl]amino]-1-oxidanylidene-propan-2-yl]-4-methyl-benzamide

Systemtic Name: N-[1-[[4-(1-adamantylmethyl)-1,3-thiazol-2-yl]amino]-1-oxidanylidene-propan-2-yl]-4-methyl-benzamide Openeye Name: N-[2-[[4-(1-adamantylmethyl)thiazol-2-yl]amino]-1-methyl-2-oxo-ethyl]-4-methyl-benzamide CAS Name: N-[1-[[4-(1-adamantylmethyl)-2-thiazolyl]amino]-1-oxopropan-2-yl]-4-methylbenzamide IUPAC Name: N-[1-[[4-(1-adamantylmethyl)-1,3-thiazol-2-yl]amino]-1-oxopropan-2-yl]-4-methylbenzamide Traditional Name: N-[2-[[4-(1-adamantylmethyl)thiazol-2-yl]amino]-2-keto-1-methyl-ethyl]-4-methyl-benzamide Formula: C25H31N3O2S MolecularWeight: 437.59754

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C(=O)NC(C)C(=O)NC2=NC(=CS2)CC34CC5CC(C3)CC(C5)C4

Isomeric SMILES

CC1=CC=C(C=C1)C(=O)NC(C)C(=O)NC2=NC(=CS2)CC34CC5CC(C3)CC(C5)C4

InChI

InChI=1S/C25H31N3O2S/c1-15-3-5-20(6-4-15)23(30)26-16(2)22(29)28-24-27-21(14-31-24)13-25-10-17-7-18(11-25)9-19(8-17)12-25/h3-6,14,16-19H,7-13H2,1-2H3,(H,26,30)(H,27,28,29)