1-oxidanyl-1-[4-[5-[1-[(2-oxidanylidene-1H-quinolin-6-yl)methoxy]ethyl]thiophen-2-yl]but-3-yn-2-yl]urea

Systemtic Name: 1-oxidanyl-1-[4-[5-[1-[(2-oxidanylidene-1H-quinolin-6-yl)methoxy]ethyl]thiophen-2-yl]but-3-yn-2-yl]urea Openeye Name: 1-hydroxy-1-[1-methyl-3-[5-[1-[(2-oxo-1H-quinolin-6-yl)methoxy]ethyl]-2-thienyl]prop-2-ynyl]urea CAS Name: 1-hydroxy-1-[4-[5-[1-[(2-oxo-1H-quinolin-6-yl)methoxy]ethyl]-2-thiophenyl]but-3-yn-2-yl]urea IUPAC Name: 1-hydroxy-1-[4-[5-[1-[(2-oxo-1H-quinolin-6-yl)methoxy]ethyl]thiophen-2-yl]but-3-yn-2-yl]urea Traditional Name: 1-hydroxy-1-[3-[5-[1-[(2-keto-1H-quinolin-6-yl)methoxy]ethyl]-2-thienyl]-1-methyl-prop-2-ynyl]urea Formula: C21H21N3O4S MolecularWeight: 411.47414

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Descriptors Computed from Structure

Canonical SMILES:

CC(C#CC1=CC=C(S1)C(C)OCC2=CC3=C(C=C2)NC(=O)C=C3)N(C(=O)N)O

Isomeric SMILES

CC(C#CC1=CC=C(S1)C(C)OCC2=CC3=C(C=C2)NC(=O)C=C3)N(C(=O)N)O

InChI

InChI=1S/C21H21N3O4S/c1-13(24(27)21(22)26)3-6-17-7-9-19(29-17)14(2)28-12-15-4-8-18-16(11-15)5-10-20(25)23-18/h4-5,7-11,13-14,27H,12H2,1-2H3,(H2,22,26)(H,23,25)