3-isothiocyanato-4-methyl-penta-1,2,4-triene

Systemtic Name: 3-isothiocyanato-4-methyl-penta-1,2,4-triene Openeye Name: 3-isothiocyanato-4-methyl-penta-1,2,4-triene CAS Name: 3-isothiocyanato-4-methylpenta-1,2,4-triene IUPAC Name: 3-isothiocyanato-4-methylpenta-1,2,4-triene Traditional Name: 3-isothiocyanato-4-methyl-penta-1,2,4-triene Formula: C7H7NS MolecularWeight: 137.20218

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Descriptors Computed from Structure

Canonical SMILES:

CC(=C)C(=C=C)N=C=S

Isomeric SMILES

CC(=C)C(=C=C)N=C=S

InChI

InChI=1S/C7H7NS/c1-4-7(6(2)3)8-5-9/h1-2H2,3H3