5-(1,3-benzothiazol-2-yl)-N-[2-(2-methylpropanoylamino)ethyl]thiophene-2-carboxamide

Systemtic Name: 5-(1,3-benzothiazol-2-yl)-N-[2-(2-methylpropanoylamino)ethyl]thiophene-2-carboxamide Openeye Name: 5-(1,3-benzothiazol-2-yl)-N-[2-(2-methylpropanoylamino)ethyl]thiophene-2-carboxamide CAS Name: 5-(1,3-benzothiazol-2-yl)-N-[2-[(2-methyl-1-oxopropyl)amino]ethyl]-2-thiophenecarboxamide IUPAC Name: 5-(1,3-benzothiazol-2-yl)-N-[2-(2-methylpropanoylamino)ethyl]thiophene-2-carboxamide Traditional Name: 5-(1,3-benzothiazol-2-yl)-N-[2-(isobutyrylamino)ethyl]thiophene-2-carboxamide Formula: C18H19N3O2S2 MolecularWeight: 373.49236

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(=O)NCCNC(=O)C1=CC=C(S1)C2=NC3=CC=CC=C3S2

Isomeric SMILES

CC(C)C(=O)NCCNC(=O)C1=CC=C(S1)C2=NC3=CC=CC=C3S2

InChI

InChI=1S/C18H19N3O2S2/c1-11(2)16(22)19-9-10-20-17(23)14-7-8-15(24-14)18-21-12-5-3-4-6-13(12)25-18/h3-8,11H,9-10H2,1-2H3,(H,19,22)(H,20,23)