(Z)-but-2-enedioic acid; N,N-dimethyl-1-(2-phenylsulfanylphenyl)propan-2-amine

Systemtic Name: (Z)-but-2-enedioic acid; N,N-dimethyl-1-(2-phenylsulfanylphenyl)propan-2-amine Openeye Name: N,N-dimethyl-1-(2-phenylsulfanylphenyl)propan-2-amine; maleic acid CAS Name: (Z)-2-butenedioic acid; N,N-dimethyl-1-[2-(phenylthio)phenyl]-2-propanamine IUPAC Name: (Z)-but-2-enedioic acid; N,N-dimethyl-1-(2-phenylsulfanylphenyl)propan-2-amine Traditional Name: dimethyl-[1-methyl-2-[2-(phenylthio)phenyl]ethyl]amine; maleic acid Formula: C21H25NO4S MolecularWeight: 387.4925

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Descriptors Computed from Structure

Canonical SMILES:

CC(CC1=CC=CC=C1SC2=CC=CC=C2)N(C)C.C(=CC(=O)O)C(=O)O

Isomeric SMILES

CC(CC1=CC=CC=C1SC2=CC=CC=C2)N(C)C.C(=C\C(=O)O)\C(=O)O

InChI

InChI=1S/C17H21NS.C4H4O4/c1-14(18(2)3)13-15-9-7-8-12-17(15)19-16-10-5-4-6-11-16;5-3(6)1-2-4(7)8/h4-12,14H,13H2,1-3H3;1-2H,(H,5,6)(H,7,8)/b;2-1-