2-(1,3-benzothiazol-2-yl)-N-[2-(2-methylpropanoylamino)ethyl]cyclohexane-1-carboxamide

Systemtic Name: 2-(1,3-benzothiazol-2-yl)-N-[2-(2-methylpropanoylamino)ethyl]cyclohexane-1-carboxamide Openeye Name: 2-(1,3-benzothiazol-2-yl)-N-[2-(2-methylpropanoylamino)ethyl]cyclohexanecarboxamide CAS Name: 2-(1,3-benzothiazol-2-yl)-N-[2-[(2-methyl-1-oxopropyl)amino]ethyl]-1-cyclohexanecarboxamide IUPAC Name: 2-(1,3-benzothiazol-2-yl)-N-[2-(2-methylpropanoylamino)ethyl]cyclohexane-1-carboxamide Traditional Name: 2-(1,3-benzothiazol-2-yl)-N-[2-(isobutyrylamino)ethyl]cyclohexanecarboxamide Formula: C20H27N3O2S MolecularWeight: 373.51228

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(=O)NCCNC(=O)C1CCCCC1C2=NC3=CC=CC=C3S2

Isomeric SMILES

CC(C)C(=O)NCCNC(=O)C1CCCCC1C2=NC3=CC=CC=C3S2

InChI

InChI=1S/C20H27N3O2S/c1-13(2)18(24)21-11-12-22-19(25)14-7-3-4-8-15(14)20-23-16-9-5-6-10-17(16)26-20/h5-6,9-10,13-15H,3-4,7-8,11-12H2,1-2H3,(H,21,24)(H,22,25)