ethanedioic acid; N-methyl-3-(4-methylnaphthalen-1-yl)oxy-3-(1,3-thiazol-4-yl)propan-1-amine; N-methyl-3-naphthalen-2-yloxy-3-thiophen-2-yl-propan-1-amine; hydrochloride

Systemtic Name: ethanedioic acid; N-methyl-3-(4-methylnaphthalen-1-yl)oxy-3-(1,3-thiazol-4-yl)propan-1-amine; N-methyl-3-naphthalen-2-yloxy-3-thiophen-2-yl-propan-1-amine; hydrochloride Openeye Name: N-methyl-3-[(4-methyl-1-naphthyl)oxy]-3-thiazol-4-yl-propan-1-amine; N-methyl-3-(2-naphthyloxy)-3-(2-thienyl)propan-1-amine; oxalic acid; hydrochloride CAS Name: N-methyl-3-[(4-methyl-1-naphthalenyl)oxy]-3-(4-thiazolyl)-1-propanamine; N-methyl-3-(2-naphthalenyloxy)-3-thiophen-2-yl-1-propanamine; oxalic acid; hydrochloride IUPAC Name: N-methyl-3-(4-methylnaphthalen-1-yl)oxy-3-(1,3-thiazol-4-yl)propan-1-amine; N-methyl-3-naphthalen-2-yloxy-3-thiophen-2-ylpropan-1-amine; oxalic acid; hydrochloride Traditional Name: methyl-[3-(4-methyl-1-naphthoxy)-3-thiazol-4-yl-propyl]amine; methyl-[3-(2-naphthoxy)-3-(2-thienyl)propyl]amine; oxalic acid; hydrochloride Formula: C38H42ClN3O6S2 MolecularWeight: 736.33958

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C2=CC=CC=C12)OC(CCNC)C3=CSC=N3.CNCCC(C1=CC=CS1)OC2=CC3=CC=CC=C3C=C2.C(=O)(C(=O)O)O.Cl

Isomeric SMILES

CC1=CC=C(C2=CC=CC=C12)OC(CCNC)C3=CSC=N3.CNCCC(C1=CC=CS1)OC2=CC3=CC=CC=C3C=C2.C(=O)(C(=O)O)O.Cl

InChI

InChI=1S/C18H20N2OS.C18H19NOS.C2H2O4.ClH/c1-13-7-8-17(15-6-4-3-5-14(13)15)21-18(9-10-19-2)16-11-22-12-20-16;1-19-11-10-17(18-7-4-12-21-18)20-16-9-8-14-5-2-3-6-15(14)13-16;3-1(4)2(5)6;/h3-8,11-12,18-19H,9-10H2,1-2H3;2-9,12-13,17,19H,10-11H2,1H3;(H,3,4)(H,5,6);1H