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

Systemtic Name: 5-[2-(azepan-1-yl)-2-oxidanylidene-ethyl]-2-(cyclohexylmethylamino)-1,3-thiazol-4-one Openeye Name: 5-[2-(azepan-1-yl)-2-oxo-ethyl]-2-(cyclohexylmethylamino)thiazol-4-one CAS Name: 5-[2-(1-azepanyl)-2-oxoethyl]-2-(cyclohexylmethylamino)-4-thiazolone IUPAC Name: 5-[2-(azepan-1-yl)-2-oxoethyl]-2-(cyclohexylmethylamino)-1,3-thiazol-4-one Traditional Name: 5-[2-(azepan-1-yl)-2-keto-ethyl]-2-(cyclohexylmethylamino)-2-thiazolin-4-one Formula: C18H29N3O2S MolecularWeight: 351.50676

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCN(CC1)C(=O)CC2C(=O)N=C(S2)NCC3CCCCC3

Isomeric SMILES

C1CCCN(CC1)C(=O)CC2C(=O)N=C(S2)NCC3CCCCC3

InChI

InChI=1S/C18H29N3O2S/c22-16(21-10-6-1-2-7-11-21)12-15-17(23)20-18(24-15)19-13-14-8-4-3-5-9-14/h14-15H,1-13H2,(H,19,20,23)