N-(1H-benzimidazol-2-ylmethyl)-2-chloranyl-5-(4-ethylpiperazin-1-yl)sulfonyl-benzamide

Systemtic Name: N-(1H-benzimidazol-2-ylmethyl)-2-chloranyl-5-(4-ethylpiperazin-1-yl)sulfonyl-benzamide Openeye Name: N-(1H-benzimidazol-2-ylmethyl)-2-chloro-5-(4-ethylpiperazin-1-yl)sulfonyl-benzamide CAS Name: N-(1H-benzimidazol-2-ylmethyl)-2-chloro-5-[(4-ethyl-1-piperazinyl)sulfonyl]benzamide IUPAC Name: N-(1H-benzimidazol-2-ylmethyl)-2-chloro-5-(4-ethylpiperazin-1-yl)sulfonylbenzamide Traditional Name: N-(1H-benzimidazol-2-ylmethyl)-2-chloro-5-(4-ethylpiperazino)sulfonyl-benzamide Formula: C21H24ClN5O3S MolecularWeight: 461.96496

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Descriptors Computed from Structure

Canonical SMILES:

CCN1CCN(CC1)S(=O)(=O)C2=CC(=C(C=C2)Cl)C(=O)NCC3=NC4=CC=CC=C4N3

Isomeric SMILES

CCN1CCN(CC1)S(=O)(=O)C2=CC(=C(C=C2)Cl)C(=O)NCC3=NC4=CC=CC=C4N3

InChI

InChI=1S/C21H24ClN5O3S/c1-2-26-9-11-27(12-10-26)31(29,30)15-7-8-17(22)16(13-15)21(28)23-14-20-24-18-5-3-4-6-19(18)25-20/h3-8,13H,2,9-12,14H2,1H3,(H,23,28)(H,24,25)