ethyl 3-(1,3-benzothiazol-2-ylamino)-2-cyclohexyl-3-oxidanylidene-propanoate

Systemtic Name: ethyl 3-(1,3-benzothiazol-2-ylamino)-2-cyclohexyl-3-oxidanylidene-propanoate Openeye Name: ethyl 3-(1,3-benzothiazol-2-ylamino)-2-cyclohexyl-3-oxo-propanoate CAS Name: 3-(1,3-benzothiazol-2-ylamino)-2-cyclohexyl-3-oxopropanoic acid ethyl ester IUPAC Name: ethyl 3-(1,3-benzothiazol-2-ylamino)-2-cyclohexyl-3-oxopropanoate Traditional Name: 3-(1,3-benzothiazol-2-ylamino)-2-cyclohexyl-3-keto-propionic acid ethyl ester Formula: C18H22N2O3S MolecularWeight: 346.44388

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(C1CCCCC1)C(=O)NC2=NC3=CC=CC=C3S2

Isomeric SMILES

CCOC(=O)C(C1CCCCC1)C(=O)NC2=NC3=CC=CC=C3S2

InChI

InChI=1S/C18H22N2O3S/c1-2-23-17(22)15(12-8-4-3-5-9-12)16(21)20-18-19-13-10-6-7-11-14(13)24-18/h6-7,10-12,15H,2-5,8-9H2,1H3,(H,19,20,21)