2,2-dimethyl-N-[(2-pyridin-4-yl-1,3-benzoxazol-5-yl)carbamothioyl]propanamide

Systemtic Name: 2,2-dimethyl-N-[(2-pyridin-4-yl-1,3-benzoxazol-5-yl)carbamothioyl]propanamide Openeye Name: 2,2-dimethyl-N-[[2-(4-pyridyl)-1,3-benzoxazol-5-yl]carbamothioyl]propanamide CAS Name: 2,2-dimethyl-N-[[(2-pyridin-4-yl-1,3-benzoxazol-5-yl)amino]-sulfanylidenemethyl]propanamide IUPAC Name: 2,2-dimethyl-N-[(2-pyridin-4-yl-1,3-benzoxazol-5-yl)carbamothioyl]propanamide Traditional Name: 2,2-dimethyl-N-[[2-(4-pyridyl)-1,3-benzoxazol-5-yl]thiocarbamoyl]propionamide Formula: C18H18N4O2S MolecularWeight: 354.42612

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C(=O)NC(=S)NC1=CC2=C(C=C1)OC(=N2)C3=CC=NC=C3

Isomeric SMILES

CC(C)(C)C(=O)NC(=S)NC1=CC2=C(C=C1)OC(=N2)C3=CC=NC=C3

InChI

InChI=1S/C18H18N4O2S/c1-18(2,3)16(23)22-17(25)20-12-4-5-14-13(10-12)21-15(24-14)11-6-8-19-9-7-11/h4-10H,1-3H3,(H2,20,22,23,25)