3-[3-(2-methyl-3,4-dihydro-2H-1,5-benzothiazepin-5-yl)-3-oxidanylidene-propyl]-1,2,3-benzotriazin-4-one

Systemtic Name: 3-[3-(2-methyl-3,4-dihydro-2H-1,5-benzothiazepin-5-yl)-3-oxidanylidene-propyl]-1,2,3-benzotriazin-4-one Openeye Name: 3-[3-(2-methyl-3,4-dihydro-2H-1,5-benzothiazepin-5-yl)-3-oxo-propyl]-1,2,3-benzotriazin-4-one CAS Name: 3-[3-(2-methyl-3,4-dihydro-2H-1,5-benzothiazepin-5-yl)-3-oxopropyl]-1,2,3-benzotriazin-4-one IUPAC Name: 3-[3-(2-methyl-3,4-dihydro-2H-1,5-benzothiazepin-5-yl)-3-oxopropyl]-1,2,3-benzotriazin-4-one Traditional Name: 3-[3-keto-3-(2-methyl-3,4-dihydro-2H-1,5-benzothiazepin-5-yl)propyl]-1,2,3-benzotriazin-4-one Formula: C20H20N4O2S MolecularWeight: 380.4634

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCN(C2=CC=CC=C2S1)C(=O)CCN3C(=O)C4=CC=CC=C4N=N3

Isomeric SMILES

CC1CCN(C2=CC=CC=C2S1)C(=O)CCN3C(=O)C4=CC=CC=C4N=N3

InChI

InChI=1S/C20H20N4O2S/c1-14-10-12-23(17-8-4-5-9-18(17)27-14)19(25)11-13-24-20(26)15-6-2-3-7-16(15)21-22-24/h2-9,14H,10-13H2,1H3