2-[1,3-benzothiazol-2-ylmethyl(methyl)amino]-N-[4-(4-ethylpiperazin-1-yl)phenyl]ethanamide

Systemtic Name: 2-[1,3-benzothiazol-2-ylmethyl(methyl)amino]-N-[4-(4-ethylpiperazin-1-yl)phenyl]ethanamide Openeye Name: 2-[1,3-benzothiazol-2-ylmethyl(methyl)amino]-N-[4-(4-ethylpiperazin-1-yl)phenyl]acetamide CAS Name: 2-[1,3-benzothiazol-2-ylmethyl(methyl)amino]-N-[4-(4-ethyl-1-piperazinyl)phenyl]acetamide IUPAC Name: 2-[1,3-benzothiazol-2-ylmethyl(methyl)amino]-N-[4-(4-ethylpiperazin-1-yl)phenyl]acetamide Traditional Name: 2-[1,3-benzothiazol-2-ylmethyl(methyl)amino]-N-[4-(4-ethylpiperazino)phenyl]acetamide Formula: C23H29N5OS MolecularWeight: 423.57426

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Descriptors Computed from Structure

Canonical SMILES:

CCN1CCN(CC1)C2=CC=C(C=C2)NC(=O)CN(C)CC3=NC4=CC=CC=C4S3

Isomeric SMILES

CCN1CCN(CC1)C2=CC=C(C=C2)NC(=O)CN(C)CC3=NC4=CC=CC=C4S3

InChI

InChI=1S/C23H29N5OS/c1-3-27-12-14-28(15-13-27)19-10-8-18(9-11-19)24-22(29)16-26(2)17-23-25-20-6-4-5-7-21(20)30-23/h4-11H,3,12-17H2,1-2H3,(H,24,29)