butylcarbamic acid; 2-propyl-1,2-benzothiazol-3-one

Systemtic Name: butylcarbamic acid; 2-propyl-1,2-benzothiazol-3-one Openeye Name: butylcarbamic acid; 2-propyl-1,2-benzothiazol-3-one CAS Name: butylcarbamic acid; 2-propyl-1,2-benzothiazol-3-one IUPAC Name: butylcarbamic acid; 2-propyl-1,2-benzothiazol-3-one Traditional Name: butylcarbamic acid; 2-propyl-1,2-benzothiazol-3-one Formula: C15H22N2O3S MolecularWeight: 310.41178

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Descriptors Computed from Structure

Canonical SMILES:

CCCCNC(=O)O.CCCN1C(=O)C2=CC=CC=C2S1

Isomeric SMILES

CCCCNC(=O)O.CCCN1C(=O)C2=CC=CC=C2S1

InChI

InChI=1S/C10H11NOS.C5H11NO2/c1-2-7-11-10(12)8-5-3-4-6-9(8)13-11;1-2-3-4-6-5(7)8/h3-6H,2,7H2,1H3;6H,2-4H2,1H3,(H,7,8)