N-[5-[(5-chloranyl-2,4-dimethoxy-phenyl)carbamothioylamino]pyridin-2-yl]ethanamide

Systemtic Name: N-[5-[(5-chloranyl-2,4-dimethoxy-phenyl)carbamothioylamino]pyridin-2-yl]ethanamide Openeye Name: N-[5-[(5-chloro-2,4-dimethoxy-phenyl)carbamothioylamino]-2-pyridyl]acetamide CAS Name: N-[5-[[(5-chloro-2,4-dimethoxyanilino)-sulfanylidenemethyl]amino]-2-pyridinyl]acetamide IUPAC Name: N-[5-[(5-chloro-2,4-dimethoxyphenyl)carbamothioylamino]pyridin-2-yl]acetamide Traditional Name: N-[5-[(5-chloro-2,4-dimethoxy-phenyl)thiocarbamoylamino]-2-pyridyl]acetamide Formula: C16H17ClN4O3S MolecularWeight: 380.84918

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=NC=C(C=C1)NC(=S)NC2=CC(=C(C=C2OC)OC)Cl

Isomeric SMILES

CC(=O)NC1=NC=C(C=C1)NC(=S)NC2=CC(=C(C=C2OC)OC)Cl

InChI

InChI=1S/C16H17ClN4O3S/c1-9(22)19-15-5-4-10(8-18-15)20-16(25)21-12-6-11(17)13(23-2)7-14(12)24-3/h4-8H,1-3H3,(H,18,19,22)(H2,20,21,25)