6-[2-oxidanyl-3-(thiophen-2-ylmethylamino)propoxy]-1H-quinolin-2-one hydrate

Systemtic Name: 6-[2-oxidanyl-3-(thiophen-2-ylmethylamino)propoxy]-1H-quinolin-2-one hydrate Openeye Name: 6-[2-hydroxy-3-(2-thienylmethylamino)propoxy]-1H-quinolin-2-one hydrate CAS Name: 6-[2-hydroxy-3-(thiophen-2-ylmethylamino)propoxy]-1H-quinolin-2-one hydrate IUPAC Name: 6-[2-hydroxy-3-(thiophen-2-ylmethylamino)propoxy]-1H-quinolin-2-one hydrate Traditional Name: 6-[2-hydroxy-3-(2-thenylamino)propoxy]carbostyril hydrate Formula: C17H20N2O4S MolecularWeight: 348.4167

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Descriptors Computed from Structure

Canonical SMILES:

C1=CSC(=C1)CNCC(COC2=CC3=C(C=C2)NC(=O)C=C3)O.O

Isomeric SMILES

C1=CSC(=C1)CNCC(COC2=CC3=C(C=C2)NC(=O)C=C3)O.O

InChI

InChI=1S/C17H18N2O3S.H2O/c20-13(9-18-10-15-2-1-7-23-15)11-22-14-4-5-16-12(8-14)3-6-17(21)19-16;/h1-8,13,18,20H,9-11H2,(H,19,21);1H2