N-[4-(1,3-benzothiazol-2-ylmethyl)phenyl]-2-[(5-chloranylthiophen-2-yl)sulfonyl-methyl-amino]ethanamide

Systemtic Name: N-[4-(1,3-benzothiazol-2-ylmethyl)phenyl]-2-[(5-chloranylthiophen-2-yl)sulfonyl-methyl-amino]ethanamide Openeye Name: N-[4-(1,3-benzothiazol-2-ylmethyl)phenyl]-2-[(5-chloro-2-thienyl)sulfonyl-methyl-amino]acetamide CAS Name: N-[4-(1,3-benzothiazol-2-ylmethyl)phenyl]-2-[(5-chloro-2-thiophenyl)sulfonyl-methylamino]acetamide IUPAC Name: N-[4-(1,3-benzothiazol-2-ylmethyl)phenyl]-2-[(5-chlorothiophen-2-yl)sulfonyl-methylamino]acetamide Traditional Name: N-[4-(1,3-benzothiazol-2-ylmethyl)phenyl]-2-[(5-chloro-2-thienyl)sulfonyl-methyl-amino]acetamide Formula: C21H18ClN3O3S3 MolecularWeight: 492.03392

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Descriptors Computed from Structure

Canonical SMILES:

CN(CC(=O)NC1=CC=C(C=C1)CC2=NC3=CC=CC=C3S2)S(=O)(=O)C4=CC=C(S4)Cl

Isomeric SMILES

CN(CC(=O)NC1=CC=C(C=C1)CC2=NC3=CC=CC=C3S2)S(=O)(=O)C4=CC=C(S4)Cl

InChI

InChI=1S/C21H18ClN3O3S3/c1-25(31(27,28)21-11-10-18(22)30-21)13-19(26)23-15-8-6-14(7-9-15)12-20-24-16-4-2-3-5-17(16)29-20/h2-11H,12-13H2,1H3,(H,23,26)