N-(4-butylphenyl)-2-(8-methoxy-4-methyl-quinolin-2-yl)sulfanyl-butanamide

Systemtic Name: N-(4-butylphenyl)-2-(8-methoxy-4-methyl-quinolin-2-yl)sulfanyl-butanamide Openeye Name: N-(4-butylphenyl)-2-[(8-methoxy-4-methyl-2-quinolyl)sulfanyl]butanamide CAS Name: N-(4-butylphenyl)-2-[(8-methoxy-4-methyl-2-quinolinyl)thio]butanamide IUPAC Name: N-(4-butylphenyl)-2-(8-methoxy-4-methylquinolin-2-yl)sulfanylbutanamide Traditional Name: N-(4-butylphenyl)-2-[(8-methoxy-4-methyl-2-quinolyl)thio]butyramide Formula: C25H30N2O2S MolecularWeight: 422.5829

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=CC=C(C=C1)NC(=O)C(CC)SC2=NC3=C(C=CC=C3OC)C(=C2)C

Isomeric SMILES

CCCCC1=CC=C(C=C1)NC(=O)C(CC)SC2=NC3=C(C=CC=C3OC)C(=C2)C

InChI

InChI=1S/C25H30N2O2S/c1-5-7-9-18-12-14-19(15-13-18)26-25(28)22(6-2)30-23-16-17(3)20-10-8-11-21(29-4)24(20)27-23/h8,10-16,22H,5-7,9H2,1-4H3,(H,26,28)