5-[2-(azepan-1-yl)-2-oxidanylidene-ethyl]-2-[(2-propan-2-ylphenyl)amino]-1,3-thiazol-4-one

Systemtic Name: 5-[2-(azepan-1-yl)-2-oxidanylidene-ethyl]-2-[(2-propan-2-ylphenyl)amino]-1,3-thiazol-4-one Openeye Name: 5-[2-(azepan-1-yl)-2-oxo-ethyl]-2-(2-isopropylanilino)thiazol-4-one CAS Name: 5-[2-(1-azepanyl)-2-oxoethyl]-2-(2-propan-2-ylanilino)-4-thiazolone IUPAC Name: 5-[2-(azepan-1-yl)-2-oxoethyl]-2-(2-propan-2-ylanilino)-1,3-thiazol-4-one Traditional Name: 5-[2-(azepan-1-yl)-2-keto-ethyl]-2-(2-isopropylanilino)-2-thiazolin-4-one Formula: C20H27N3O2S MolecularWeight: 373.51228

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC=CC=C1NC2=NC(=O)C(S2)CC(=O)N3CCCCCC3

Isomeric SMILES

CC(C)C1=CC=CC=C1NC2=NC(=O)C(S2)CC(=O)N3CCCCCC3

InChI

InChI=1S/C20H27N3O2S/c1-14(2)15-9-5-6-10-16(15)21-20-22-19(25)17(26-20)13-18(24)23-11-7-3-4-8-12-23/h5-6,9-10,14,17H,3-4,7-8,11-13H2,1-2H3,(H,21,22,25)