7-bromanyl-1,1-bis(oxidanylidene)-N-propan-2-yl-2,3,4,5-tetrahydro-1$l^{6}-benzothiepin-5-amine

Systemtic Name: 7-bromanyl-1,1-bis(oxidanylidene)-N-propan-2-yl-2,3,4,5-tetrahydro-1$l^{6}-benzothiepin-5-amine Openeye Name: 7-bromo-N-isopropyl-1,1-dioxo-2,3,4,5-tetrahydro-1$l^{6}-benzothiepin-5-amine CAS Name: 7-bromo-1,1-dioxo-N-propan-2-yl-2,3,4,5-tetrahydro-1$l^{6}-benzothiepin-5-amine IUPAC Name: 7-bromo-1,1-dioxo-N-propan-2-yl-2,3,4,5-tetrahydro-1$l^{6}-benzothiepin-5-amine Traditional Name: (7-bromo-1,1-diketo-2,3,4,5-tetrahydro-1$l^{6}-benzothiepin-5-yl)-isopropyl-amine Formula: C13H18BrNO2S MolecularWeight: 332.25652

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)NC1CCCS(=O)(=O)C2=C1C=C(C=C2)Br

Isomeric SMILES

CC(C)NC1CCCS(=O)(=O)C2=C1C=C(C=C2)Br

InChI

InChI=1S/C13H18BrNO2S/c1-9(2)15-12-4-3-7-18(16,17)13-6-5-10(14)8-11(12)13/h5-6,8-9,12,15H,3-4,7H2,1-2H3