3H-1,3-benzothiazole-2-thione; methylbenzene

Systemtic Name: 3H-1,3-benzothiazole-2-thione; methylbenzene Openeye Name: 3H-1,3-benzothiazole-2-thione; toluene CAS Name: 3H-1,3-benzothiazole-2-thione; toluene IUPAC Name: 3H-1,3-benzothiazole-2-thione; toluene Traditional Name: 3H-1,3-benzothiazole-2-thione; toluene Formula: C14H13NS2 MolecularWeight: 259.38972

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1.C1=CC=C2C(=C1)NC(=S)S2

Isomeric SMILES

CC1=CC=CC=C1.C1=CC=C2C(=C1)NC(=S)S2

InChI

InChI=1S/C7H5NS2.C7H8/c9-7-8-5-3-1-2-4-6(5)10-7;1-7-5-3-2-4-6-7/h1-4H,(H,8,9);2-6H,1H3