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

Systemtic Name: 1,1-bis(oxidanylidene)-7-propan-2-yl-2,3,4,5-tetrahydro-1$l^{6}-benzothiepin-5-amine Openeye Name: 7-isopropyl-1,1-dioxo-2,3,4,5-tetrahydro-1$l^{6}-benzothiepin-5-amine CAS Name: 1,1-dioxo-7-propan-2-yl-2,3,4,5-tetrahydro-1$l^{6}-benzothiepin-5-amine IUPAC Name: 1,1-dioxo-7-propan-2-yl-2,3,4,5-tetrahydro-1$l^{6}-benzothiepin-5-amine Traditional Name: (7-isopropyl-1,1-diketo-2,3,4,5-tetrahydro-1$l^{6}-benzothiepin-5-yl)amine Formula: C13H19NO2S MolecularWeight: 253.36046

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC2=C(C=C1)S(=O)(=O)CCCC2N

Isomeric SMILES

CC(C)C1=CC2=C(C=C1)S(=O)(=O)CCCC2N

InChI

InChI=1S/C13H19NO2S/c1-9(2)10-5-6-13-11(8-10)12(14)4-3-7-17(13,15)16/h5-6,8-9,12H,3-4,7,14H2,1-2H3