N-(1,3-benzodioxol-5-ylmethyl)-4-(5-methyl-1,3-benzothiazol-2-yl)aniline

Systemtic Name: N-(1,3-benzodioxol-5-ylmethyl)-4-(5-methyl-1,3-benzothiazol-2-yl)aniline Openeye Name: N-(1,3-benzodioxol-5-ylmethyl)-4-(5-methyl-1,3-benzothiazol-2-yl)aniline CAS Name: N-(1,3-benzodioxol-5-ylmethyl)-4-(5-methyl-1,3-benzothiazol-2-yl)aniline IUPAC Name: N-(1,3-benzodioxol-5-ylmethyl)-4-(5-methyl-1,3-benzothiazol-2-yl)aniline Traditional Name: [4-(5-methyl-1,3-benzothiazol-2-yl)phenyl]-piperonyl-amine Formula: C22H18N2O2S MolecularWeight: 374.45552

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)SC(=N2)C3=CC=C(C=C3)NCC4=CC5=C(C=C4)OCO5

Isomeric SMILES

CC1=CC2=C(C=C1)SC(=N2)C3=CC=C(C=C3)NCC4=CC5=C(C=C4)OCO5

InChI

InChI=1S/C22H18N2O2S/c1-14-2-9-21-18(10-14)24-22(27-21)16-4-6-17(7-5-16)23-12-15-3-8-19-20(11-15)26-13-25-19/h2-11,23H,12-13H2,1H3