(2-methyl-6-propoxy-3-propyl-quinolin-4-yl)sulfanylmethanediamine

Systemtic Name: (2-methyl-6-propoxy-3-propyl-quinolin-4-yl)sulfanylmethanediamine Openeye Name: (2-methyl-6-propoxy-3-propyl-4-quinolyl)sulfanylmethanediamine CAS Name: [(2-methyl-6-propoxy-3-propyl-4-quinolinyl)thio]methanediamine IUPAC Name: (2-methyl-6-propoxy-3-propylquinolin-4-yl)sulfanylmethanediamine Traditional Name: [amino-[(2-methyl-6-propoxy-3-propyl-4-quinolyl)thio]methyl]amine Formula: C17H25N3OS MolecularWeight: 319.4649

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=C(C2=C(C=CC(=C2)OCCC)N=C1C)SC(N)N

Isomeric SMILES

CCCC1=C(C2=C(C=CC(=C2)OCCC)N=C1C)SC(N)N

InChI

InChI=1S/C17H25N3OS/c1-4-6-13-11(3)20-15-8-7-12(21-9-5-2)10-14(15)16(13)22-17(18)19/h7-8,10,17H,4-6,9,18-19H2,1-3H3