5-butyl-1,1-bis(oxidanylidene)-3H-1$l^{6},2,5-benzothiadiazepin-2-id-4-one

Systemtic Name: 5-butyl-1,1-bis(oxidanylidene)-3H-1$l^{6},2,5-benzothiadiazepin-2-id-4-one Openeye Name: 5-butyl-1,1-dioxo-3H-1$l^{6},2,5-benzothiadiazepin-2-id-4-one CAS Name: 5-butyl-1,1-dioxo-3H-1$l^{6},2,5-benzothiadiazepin-2-id-4-one IUPAC Name: 5-butyl-1,1-dioxo-3H-1$l^{6},2,5-benzothiadiazepin-2-id-4-one Traditional Name: 5-butyl-1,1-diketo-3H-1$l^{6},2,5-benzothiadiazepin-2-id-4-one Formula: C12H15N2O3S- MolecularWeight: 267.3241

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C(=O)C[N-]S(=O)(=O)C2=CC=CC=C21

Isomeric SMILES

CCCCN1C(=O)C[N-]S(=O)(=O)C2=CC=CC=C21

InChI

InChI=1S/C12H15N2O3S/c1-2-3-8-14-10-6-4-5-7-11(10)18(16,17)13-9-12(14)15/h4-7H,2-3,8-9H2,1H3/q-1