N2-(1,3-benzothiazol-2-ylmethyl)-N1,N1-dimethyl-4-piperidin-1-ylsulfonyl-benzene-1,2-diamine

Systemtic Name: N2-(1,3-benzothiazol-2-ylmethyl)-N1,N1-dimethyl-4-piperidin-1-ylsulfonyl-benzene-1,2-diamine Openeye Name: N2-(1,3-benzothiazol-2-ylmethyl)-N1,N1-dimethyl-4-(1-piperidylsulfonyl)benzene-1,2-diamine CAS Name: N2-(1,3-benzothiazol-2-ylmethyl)-N1,N1-dimethyl-4-(1-piperidinylsulfonyl)benzene-1,2-diamine IUPAC Name: 2-N-(1,3-benzothiazol-2-ylmethyl)-1-N,1-N-dimethyl-4-piperidin-1-ylsulfonylbenzene-1,2-diamine Traditional Name: [2-(1,3-benzothiazol-2-ylmethylamino)-4-piperidinosulfonyl-phenyl]-dimethyl-amine Formula: C21H26N4O2S2 MolecularWeight: 430.58674

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)C1=C(C=C(C=C1)S(=O)(=O)N2CCCCC2)NCC3=NC4=CC=CC=C4S3

Isomeric SMILES

CN(C)C1=C(C=C(C=C1)S(=O)(=O)N2CCCCC2)NCC3=NC4=CC=CC=C4S3

InChI

InChI=1S/C21H26N4O2S2/c1-24(2)19-11-10-16(29(26,27)25-12-6-3-7-13-25)14-18(19)22-15-21-23-17-8-4-5-9-20(17)28-21/h4-5,8-11,14,22H,3,6-7,12-13,15H2,1-2H3