5-[2-(4-dimethylaminophenyl)-3,5-dihydro-2H-1,5-benzothiazepin-4-ylidene]-1,3-dimethyl-2-sulfanylidene-1,3-diazinane-4,6-dione

Systemtic Name: 5-[2-(4-dimethylaminophenyl)-3,5-dihydro-2H-1,5-benzothiazepin-4-ylidene]-1,3-dimethyl-2-sulfanylidene-1,3-diazinane-4,6-dione Openeye Name: 5-[2-(4-dimethylaminophenyl)-3,5-dihydro-2H-1,5-benzothiazepin-4-ylidene]-1,3-dimethyl-2-thioxo-hexahydropyrimidine-4,6-dione CAS Name: 5-[2-(4-dimethylaminophenyl)-3,5-dihydro-2H-1,5-benzothiazepin-4-ylidene]-1,3-dimethyl-2-sulfanylidene-1,3-diazinane-4,6-dione IUPAC Name: 5-[2-(4-dimethylaminophenyl)-3,5-dihydro-2H-1,5-benzothiazepin-4-ylidene]-1,3-dimethyl-2-sulfanylidene-1,3-diazinane-4,6-dione Traditional Name: 5-[2-(4-dimethylaminophenyl)-3,5-dihydro-2H-1,5-benzothiazepin-4-ylidene]-1,3-dimethyl-2-thioxo-hexahydropyrimidine-4,6-quinone Formula: C23H24N4O2S2 MolecularWeight: 452.59226

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=O)C(=C2CC(SC3=CC=CC=C3N2)C4=CC=C(C=C4)N(C)C)C(=O)N(C1=S)C

Isomeric SMILES

CN1C(=O)C(=C2CC(SC3=CC=CC=C3N2)C4=CC=C(C=C4)N(C)C)C(=O)N(C1=S)C

InChI

InChI=1S/C23H24N4O2S2/c1-25(2)15-11-9-14(10-12-15)19-13-17(24-16-7-5-6-8-18(16)31-19)20-21(28)26(3)23(30)27(4)22(20)29/h5-12,19,24H,13H2,1-4H3