N-[(2-phenyl-6-propan-2-ylperoxy-1,3-benzothiazol-5-yl)methyl]heptan-3-amine

Systemtic Name: N-[(2-phenyl-6-propan-2-ylperoxy-1,3-benzothiazol-5-yl)methyl]heptan-3-amine Openeye Name: N-[(6-isopropylperoxy-2-phenyl-1,3-benzothiazol-5-yl)methyl]heptan-3-amine CAS Name: N-[(2-phenyl-6-propan-2-yldioxy-1,3-benzothiazol-5-yl)methyl]-3-heptanamine IUPAC Name: N-[(2-phenyl-6-propan-2-ylperoxy-1,3-benzothiazol-5-yl)methyl]heptan-3-amine Traditional Name: 1-ethylpentyl-[(6-isopropylperoxy-2-phenyl-1,3-benzothiazol-5-yl)methyl]amine Formula: C24H32N2O2S MolecularWeight: 412.58808

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(CC)NCC1=CC2=C(C=C1OOC(C)C)SC(=N2)C3=CC=CC=C3

Isomeric SMILES

CCCCC(CC)NCC1=CC2=C(C=C1OOC(C)C)SC(=N2)C3=CC=CC=C3

InChI

InChI=1S/C24H32N2O2S/c1-5-7-13-20(6-2)25-16-19-14-21-23(15-22(19)28-27-17(3)4)29-24(26-21)18-11-9-8-10-12-18/h8-12,14-15,17,20,25H,5-7,13,16H2,1-4H3