1-oxidanyl-1-[2-[[1-oxidanylidene-2-(3-thiophen-2-ylpropyl)-3,4-dihydroisoquinolin-6-yl]oxy]ethyl]urea

Systemtic Name: 1-oxidanyl-1-[2-[[1-oxidanylidene-2-(3-thiophen-2-ylpropyl)-3,4-dihydroisoquinolin-6-yl]oxy]ethyl]urea Openeye Name: 1-hydroxy-1-[2-[[1-oxo-2-[3-(2-thienyl)propyl]-3,4-dihydroisoquinolin-6-yl]oxy]ethyl]urea CAS Name: 1-hydroxy-1-[2-[[1-oxo-2-(3-thiophen-2-ylpropyl)-3,4-dihydroisoquinolin-6-yl]oxy]ethyl]urea IUPAC Name: 1-hydroxy-1-[2-[[1-oxo-2-(3-thiophen-2-ylpropyl)-3,4-dihydroisoquinolin-6-yl]oxy]ethyl]urea Traditional Name: 1-hydroxy-1-[2-[[1-keto-2-[3-(2-thienyl)propyl]-3,4-dihydroisoquinolin-6-yl]oxy]ethyl]urea Formula: C19H23N3O4S MolecularWeight: 389.46862

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(C(=O)C2=C1C=C(C=C2)OCCN(C(=O)N)O)CCCC3=CC=CS3

Isomeric SMILES

C1CN(C(=O)C2=C1C=C(C=C2)OCCN(C(=O)N)O)CCCC3=CC=CS3

InChI

InChI=1S/C19H23N3O4S/c20-19(24)22(25)10-11-26-15-5-6-17-14(13-15)7-9-21(18(17)23)8-1-3-16-4-2-12-27-16/h2,4-6,12-13,25H,1,3,7-11H2,(H2,20,24)