2-ethyl-N-(phenylmethyl)imidazole-1-carbothioamide

Systemtic Name: 2-ethyl-N-(phenylmethyl)imidazole-1-carbothioamide Openeye Name: N-benzyl-2-ethyl-imidazole-1-carbothioamide CAS Name: 2-ethyl-N-(phenylmethyl)-1-imidazolecarbothioamide IUPAC Name: N-benzyl-2-ethylimidazole-1-carbothioamide Traditional Name: N-benzyl-2-ethyl-imidazole-1-carbothioamide Formula: C13H15N3S MolecularWeight: 245.3433

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=NC=CN1C(=S)NCC2=CC=CC=C2

Isomeric SMILES

CCC1=NC=CN1C(=S)NCC2=CC=CC=C2

InChI

InChI=1S/C13H15N3S/c1-2-12-14-8-9-16(12)13(17)15-10-11-6-4-3-5-7-11/h3-9H,2,10H2,1H3,(H,15,17)