6-tert-butylsulfanyl-4-[(3-methoxyphenyl)amino]quinoline-3-carboxamide

Systemtic Name: 6-tert-butylsulfanyl-4-[(3-methoxyphenyl)amino]quinoline-3-carboxamide Openeye Name: 6-tert-butylsulfanyl-4-(3-methoxyanilino)quinoline-3-carboxamide CAS Name: 6-(tert-butylthio)-4-(3-methoxyanilino)-3-quinolinecarboxamide IUPAC Name: 6-tert-butylsulfanyl-4-(3-methoxyanilino)quinoline-3-carboxamide Traditional Name: 6-(tert-butylthio)-4-(m-anisidino)quinoline-3-carboxamide Formula: C21H23N3O2S MolecularWeight: 381.49122

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)SC1=CC2=C(C(=CN=C2C=C1)C(=O)N)NC3=CC(=CC=C3)OC

Isomeric SMILES

CC(C)(C)SC1=CC2=C(C(=CN=C2C=C1)C(=O)N)NC3=CC(=CC=C3)OC

InChI

InChI=1S/C21H23N3O2S/c1-21(2,3)27-15-8-9-18-16(11-15)19(17(12-23-18)20(22)25)24-13-6-5-7-14(10-13)26-4/h5-12H,1-4H3,(H2,22,25)(H,23,24)