1-[4-(3-methoxypyridin-2-yl)butyl]-3-methyl-thiourea

Systemtic Name: 1-[4-(3-methoxypyridin-2-yl)butyl]-3-methyl-thiourea Openeye Name: 1-[4-(3-methoxy-2-pyridyl)butyl]-3-methyl-thiourea CAS Name: 1-[4-(3-methoxy-2-pyridinyl)butyl]-3-methylthiourea IUPAC Name: 1-[4-(3-methoxypyridin-2-yl)butyl]-3-methylthiourea Traditional Name: 1-[4-(3-methoxy-2-pyridyl)butyl]-3-methyl-thiourea Formula: C12H19N3OS MolecularWeight: 253.36376

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Descriptors Computed from Structure

Canonical SMILES:

CNC(=S)NCCCCC1=C(C=CC=N1)OC

Isomeric SMILES

CNC(=S)NCCCCC1=C(C=CC=N1)OC

InChI

InChI=1S/C12H19N3OS/c1-13-12(17)15-8-4-3-6-10-11(16-2)7-5-9-14-10/h5,7,9H,3-4,6,8H2,1-2H3,(H2,13,15,17)