6-[4-(4-cyclohexylphenyl)sulfinylbutoxy]-1H-quinolin-2-one

Systemtic Name: 6-[4-(4-cyclohexylphenyl)sulfinylbutoxy]-1H-quinolin-2-one Openeye Name: 6-[4-(4-cyclohexylphenyl)sulfinylbutoxy]-1H-quinolin-2-one CAS Name: 6-[4-(4-cyclohexylphenyl)sulfinylbutoxy]-1H-quinolin-2-one IUPAC Name: 6-[4-(4-cyclohexylphenyl)sulfinylbutoxy]-1H-quinolin-2-one Traditional Name: 6-[4-(4-cyclohexylphenyl)sulfinylbutoxy]carbostyril Formula: C25H29NO3S MolecularWeight: 423.56766

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)C2=CC=C(C=C2)S(=O)CCCCOC3=CC4=C(C=C3)NC(=O)C=C4

Isomeric SMILES

C1CCC(CC1)C2=CC=C(C=C2)S(=O)CCCCOC3=CC4=C(C=C3)NC(=O)C=C4

InChI

InChI=1S/C25H29NO3S/c27-25-15-10-21-18-22(11-14-24(21)26-25)29-16-4-5-17-30(28)23-12-8-20(9-13-23)19-6-2-1-3-7-19/h8-15,18-19H,1-7,16-17H2,(H,26,27)