4-(3-methylbutoxy)-N-(pyridin-3-ylmethylcarbamothioyl)benzamide

Systemtic Name: 4-(3-methylbutoxy)-N-(pyridin-3-ylmethylcarbamothioyl)benzamide Openeye Name: 4-isopentyloxy-N-(3-pyridylmethylcarbamothioyl)benzamide CAS Name: 4-(3-methylbutoxy)-N-[(3-pyridinylmethylamino)-sulfanylidenemethyl]benzamide IUPAC Name: 4-(3-methylbutoxy)-N-(pyridin-3-ylmethylcarbamothioyl)benzamide Traditional Name: 4-isoamoxy-N-(3-pyridylmethylthiocarbamoyl)benzamide Formula: C19H23N3O2S MolecularWeight: 357.46982

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCOC1=CC=C(C=C1)C(=O)NC(=S)NCC2=CN=CC=C2

Isomeric SMILES

CC(C)CCOC1=CC=C(C=C1)C(=O)NC(=S)NCC2=CN=CC=C2

InChI

InChI=1S/C19H23N3O2S/c1-14(2)9-11-24-17-7-5-16(6-8-17)18(23)22-19(25)21-13-15-4-3-10-20-12-15/h3-8,10,12,14H,9,11,13H2,1-2H3,(H2,21,22,23,25)