2-(3-azanylpropyl)-1,1-bis(oxidanylidene)-1,2-benzothiazol-3-one

Systemtic Name: 2-(3-azanylpropyl)-1,1-bis(oxidanylidene)-1,2-benzothiazol-3-one Openeye Name: 2-(3-aminopropyl)-1,1-dioxo-1,2-benzothiazol-3-one CAS Name: 2-(3-aminopropyl)-1,1-dioxo-1,2-benzothiazol-3-one IUPAC Name: 2-(3-aminopropyl)-1,1-dioxo-1,2-benzothiazol-3-one Traditional Name: 2-(3-aminopropyl)-1,1-diketo-1,2-benzothiazol-3-one Formula: C10H12N2O3S MolecularWeight: 240.27888

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=O)N(S2(=O)=O)CCCN

Isomeric SMILES

C1=CC=C2C(=C1)C(=O)N(S2(=O)=O)CCCN

InChI

InChI=1S/C10H12N2O3S/c11-6-3-7-12-10(13)8-4-1-2-5-9(8)16(12,14)15/h1-2,4-5H,3,6-7,11H2