azane; 7-(5-ethylsulfonylpentyl)-4-methoxy-2,3-dihydro-1,3-benzothiazole 1-oxide; 2-phenylethanamine; dihydrochloride

Systemtic Name: azane; 7-(5-ethylsulfonylpentyl)-4-methoxy-2,3-dihydro-1,3-benzothiazole 1-oxide; 2-phenylethanamine; dihydrochloride Openeye Name: ammonia; 7-(5-ethylsulfonylpentyl)-4-methoxy-2,3-dihydro-1,3-benzothiazole 1-oxide; 2-phenylethanamine; dihydrochloride CAS Name: ammonia; 7-(5-ethylsulfonylpentyl)-4-methoxy-2,3-dihydro-1,3-benzothiazole 1-oxide; 2-phenylethanamine; dihydrochloride IUPAC Name: azane; 7-(5-ethylsulfonylpentyl)-4-methoxy-2,3-dihydro-1,3-benzothiazole 1-oxide; 2-phenylethanamine; dihydrochloride Traditional Name: ammonia; 7-(5-esylpentyl)-4-methoxy-2,3-dihydro-1,3-benzothiazole 1-oxide; phenethylamine; dihydrochloride Formula: C23H39Cl2N3O4S2 MolecularWeight: 556.60946

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Descriptors Computed from Structure

Canonical SMILES:

CCS(=O)(=O)CCCCCC1=C2C(=C(C=C1)OC)NCS2=O.C1=CC=C(C=C1)CCN.N.Cl.Cl

Isomeric SMILES

CCS(=O)(=O)CCCCCC1=C2C(=C(C=C1)OC)NCS2=O.C1=CC=C(C=C1)CCN.N.Cl.Cl

InChI

InChI=1S/C15H23NO4S2.C8H11N.2ClH.H3N/c1-3-22(18,19)10-6-4-5-7-12-8-9-13(20-2)14-15(12)21(17)11-16-14;9-7-6-8-4-2-1-3-5-8;;;/h8-9,16H,3-7,10-11H2,1-2H3;1-5H,6-7,9H2;2*1H;1H3