1-[4-[5-[(1-methyl-2-oxidanylidene-quinolin-6-yl)methoxymethyl]thiophen-2-yl]but-3-yn-2-yl]-1-oxidanyl-urea

Systemtic Name: 1-[4-[5-[(1-methyl-2-oxidanylidene-quinolin-6-yl)methoxymethyl]thiophen-2-yl]but-3-yn-2-yl]-1-oxidanyl-urea Openeye Name: 1-hydroxy-1-[1-methyl-3-[5-[(1-methyl-2-oxo-6-quinolyl)methoxymethyl]-2-thienyl]prop-2-ynyl]urea CAS Name: 1-hydroxy-1-[4-[5-[(1-methyl-2-oxo-6-quinolinyl)methoxymethyl]-2-thiophenyl]but-3-yn-2-yl]urea IUPAC Name: 1-hydroxy-1-[4-[5-[(1-methyl-2-oxoquinolin-6-yl)methoxymethyl]thiophen-2-yl]but-3-yn-2-yl]urea Traditional Name: 1-hydroxy-1-[3-[5-[(2-keto-1-methyl-6-quinolyl)methoxymethyl]-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)COCC2=CC3=C(C=C2)N(C(=O)C=C3)C)N(C(=O)N)O

Isomeric SMILES

CC(C#CC1=CC=C(S1)COCC2=CC3=C(C=C2)N(C(=O)C=C3)C)N(C(=O)N)O

InChI

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