4-tert-butyl-7-chloranyl-2-sulfanylidene-1,3-dihydro-1,3,4-benzotriazepin-5-one

Systemtic Name: 4-tert-butyl-7-chloranyl-2-sulfanylidene-1,3-dihydro-1,3,4-benzotriazepin-5-one Openeye Name: 4-tert-butyl-7-chloro-2-thioxo-1,3-dihydro-1,3,4-benzotriazepin-5-one CAS Name: 4-tert-butyl-7-chloro-2-sulfanylidene-1,3-dihydro-1,3,4-benzotriazepin-5-one IUPAC Name: 4-tert-butyl-7-chloro-2-sulfanylidene-1,3-dihydro-1,3,4-benzotriazepin-5-one Traditional Name: 4-tert-butyl-7-chloro-2-thioxo-1,3-dihydro-1,3,4-benzotriazepin-5-one Formula: C12H14ClN3OS MolecularWeight: 283.77706

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)N1C(=O)C2=C(C=CC(=C2)Cl)NC(=S)N1

Isomeric SMILES

CC(C)(C)N1C(=O)C2=C(C=CC(=C2)Cl)NC(=S)N1

InChI

InChI=1S/C12H14ClN3OS/c1-12(2,3)16-10(17)8-6-7(13)4-5-9(8)14-11(18)15-16/h4-6H,1-3H3,(H2,14,15,18)