N2-tert-butyl-N3-pyridin-2-yl-4,5,6,7-tetrahydro-1-benzothiophene-2,3-dicarboxamide

Systemtic Name: N2-tert-butyl-N3-pyridin-2-yl-4,5,6,7-tetrahydro-1-benzothiophene-2,3-dicarboxamide Openeye Name: N2-tert-butyl-N3-(2-pyridyl)-4,5,6,7-tetrahydrobenzothiophene-2,3-dicarboxamide CAS Name: N2-tert-butyl-N3-(2-pyridinyl)-4,5,6,7-tetrahydro-1-benzothiophene-2,3-dicarboxamide IUPAC Name: 2-N-tert-butyl-3-N-pyridin-2-yl-4,5,6,7-tetrahydro-1-benzothiophene-2,3-dicarboxamide Traditional Name: N-tert-butyl-N'-(2-pyridyl)-4,5,6,7-tetrahydrobenzothiophene-2,3-dicarboxamide Formula: C19H23N3O2S MolecularWeight: 357.46982

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)NC(=O)C1=C(C2=C(S1)CCCC2)C(=O)NC3=CC=CC=N3

Isomeric SMILES

CC(C)(C)NC(=O)C1=C(C2=C(S1)CCCC2)C(=O)NC3=CC=CC=N3

InChI

InChI=1S/C19H23N3O2S/c1-19(2,3)22-18(24)16-15(12-8-4-5-9-13(12)25-16)17(23)21-14-10-6-7-11-20-14/h6-7,10-11H,4-5,8-9H2,1-3H3,(H,22,24)(H,20,21,23)