1,3-benzothiazole; 2-prop-2-enyl-2-sulfanyl-cyclopentan-1-one

Systemtic Name: 1,3-benzothiazole; 2-prop-2-enyl-2-sulfanyl-cyclopentan-1-one Openeye Name: 2-allyl-2-sulfanyl-cyclopentanone; 1,3-benzothiazole CAS Name: 1,3-benzothiazole; 2-mercapto-2-prop-2-enyl-1-cyclopentanone IUPAC Name: 1,3-benzothiazole; 2-prop-2-enyl-2-sulfanylcyclopentan-1-one Traditional Name: 2-allyl-2-mercapto-cyclopentanone; 1,3-benzothiazole Formula: C15H17NOS2 MolecularWeight: 291.43158

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Descriptors Computed from Structure

Canonical SMILES:

C=CCC1(CCCC1=O)S.C1=CC=C2C(=C1)N=CS2

Isomeric SMILES

C=CCC1(CCCC1=O)S.C1=CC=C2C(=C1)N=CS2

InChI

InChI=1S/C8H12OS.C7H5NS/c1-2-5-8(10)6-3-4-7(8)9;1-2-4-7-6(3-1)8-5-9-7/h2,10H,1,3-6H2;1-5H