2-[2-[1-(3-methoxy-4-propan-2-yloxy-phenyl)ethylamino]-2-oxidanylidene-ethyl]sulfanyl-N-(5-methyl-1,2-oxazol-3-yl)propanamide

Systemtic Name: 2-[2-[1-(3-methoxy-4-propan-2-yloxy-phenyl)ethylamino]-2-oxidanylidene-ethyl]sulfanyl-N-(5-methyl-1,2-oxazol-3-yl)propanamide Openeye Name: 2-[2-[1-(4-isopropoxy-3-methoxy-phenyl)ethylamino]-2-oxo-ethyl]sulfanyl-N-(5-methylisoxazol-3-yl)propanamide CAS Name: 2-[[2-[1-(3-methoxy-4-propan-2-yloxyphenyl)ethylamino]-2-oxoethyl]thio]-N-(5-methyl-3-isoxazolyl)propanamide IUPAC Name: 2-[2-[1-(3-methoxy-4-propan-2-yloxyphenyl)ethylamino]-2-oxoethyl]sulfanyl-N-(5-methyl-1,2-oxazol-3-yl)propanamide Traditional Name: 2-[[2-[1-(4-isopropoxy-3-methoxy-phenyl)ethylamino]-2-keto-ethyl]thio]-N-(5-methylisoxazol-3-yl)propionamide Formula: C21H29N3O5S MolecularWeight: 435.53706

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NO1)NC(=O)C(C)SCC(=O)NC(C)C2=CC(=C(C=C2)OC(C)C)OC

Isomeric SMILES

CC1=CC(=NO1)NC(=O)C(C)SCC(=O)NC(C)C2=CC(=C(C=C2)OC(C)C)OC

InChI

InChI=1S/C21H29N3O5S/c1-12(2)28-17-8-7-16(10-18(17)27-6)14(4)22-20(25)11-30-15(5)21(26)23-19-9-13(3)29-24-19/h7-10,12,14-15H,11H2,1-6H3,(H,22,25)(H,23,24,26)