N-[5-(2-thiophen-2-ylethanoylamino)-1,3-benzothiazol-2-yl]cyclohexanecarboxamide

Systemtic Name: N-[5-(2-thiophen-2-ylethanoylamino)-1,3-benzothiazol-2-yl]cyclohexanecarboxamide Openeye Name: N-[5-[[2-(2-thienyl)acetyl]amino]-1,3-benzothiazol-2-yl]cyclohexanecarboxamide CAS Name: N-[5-[(1-oxo-2-thiophen-2-ylethyl)amino]-1,3-benzothiazol-2-yl]cyclohexanecarboxamide IUPAC Name: N-[5-[(2-thiophen-2-ylacetyl)amino]-1,3-benzothiazol-2-yl]cyclohexanecarboxamide Traditional Name: N-[5-[[2-(2-thienyl)acetyl]amino]-1,3-benzothiazol-2-yl]cyclohexanecarboxamide Formula: C20H21N3O2S2 MolecularWeight: 399.52964

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)C(=O)NC2=NC3=C(S2)C=CC(=C3)NC(=O)CC4=CC=CS4

Isomeric SMILES

C1CCC(CC1)C(=O)NC2=NC3=C(S2)C=CC(=C3)NC(=O)CC4=CC=CS4

InChI

InChI=1S/C20H21N3O2S2/c24-18(12-15-7-4-10-26-15)21-14-8-9-17-16(11-14)22-20(27-17)23-19(25)13-5-2-1-3-6-13/h4,7-11,13H,1-3,5-6,12H2,(H,21,24)(H,22,23,25)