2-[2-[(5-chloranylthiophen-2-yl)methyl-ethyl-amino]-2-oxidanylidene-ethyl]sulfanyl-N-(5-methyl-1,2-oxazol-3-yl)propanamide

Systemtic Name: 2-[2-[(5-chloranylthiophen-2-yl)methyl-ethyl-amino]-2-oxidanylidene-ethyl]sulfanyl-N-(5-methyl-1,2-oxazol-3-yl)propanamide Openeye Name: 2-[2-[(5-chloro-2-thienyl)methyl-ethyl-amino]-2-oxo-ethyl]sulfanyl-N-(5-methylisoxazol-3-yl)propanamide CAS Name: 2-[[2-[(5-chloro-2-thiophenyl)methyl-ethylamino]-2-oxoethyl]thio]-N-(5-methyl-3-isoxazolyl)propanamide IUPAC Name: 2-[2-[(5-chlorothiophen-2-yl)methyl-ethylamino]-2-oxoethyl]sulfanyl-N-(5-methyl-1,2-oxazol-3-yl)propanamide Traditional Name: 2-[[2-[(5-chloro-2-thienyl)methyl-ethyl-amino]-2-keto-ethyl]thio]-N-(5-methylisoxazol-3-yl)propionamide Formula: C16H20ClN3O3S2 MolecularWeight: 401.9313

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC1=CC=C(S1)Cl)C(=O)CSC(C)C(=O)NC2=NOC(=C2)C

Isomeric SMILES

CCN(CC1=CC=C(S1)Cl)C(=O)CSC(C)C(=O)NC2=NOC(=C2)C

InChI

InChI=1S/C16H20ClN3O3S2/c1-4-20(8-12-5-6-13(17)25-12)15(21)9-24-11(3)16(22)18-14-7-10(2)23-19-14/h5-7,11H,4,8-9H2,1-3H3,(H,18,19,22)