1-butyl-3-[(E)-(6-methylpyridin-2-yl)methylideneamino]thiourea

Systemtic Name: 1-butyl-3-[(E)-(6-methylpyridin-2-yl)methylideneamino]thiourea Openeye Name: 1-butyl-3-[(E)-(6-methyl-2-pyridyl)methyleneamino]thiourea CAS Name: 1-butyl-3-[(E)-(6-methyl-2-pyridinyl)methylideneamino]thiourea IUPAC Name: 1-butyl-3-[(E)-(6-methylpyridin-2-yl)methylideneamino]thiourea Traditional Name: 1-butyl-3-[(E)-(6-methyl-2-pyridyl)methyleneamino]thiourea Formula: C12H18N4S MolecularWeight: 250.36312

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Descriptors Computed from Structure

Canonical SMILES:

CCCCNC(=S)NN=CC1=NC(=CC=C1)C

Isomeric SMILES

CCCCNC(=S)N/N=C/C1=NC(=CC=C1)C

InChI

InChI=1S/C12H18N4S/c1-3-4-8-13-12(17)16-14-9-11-7-5-6-10(2)15-11/h5-7,9H,3-4,8H2,1-2H3,(H2,13,16,17)/b14-9+