1-methyl-3-[(2R)-2-thiophen-2-yl-3,5-dihydro-2H-1,5-benzothiazepin-4-ylidene]quinoline-2,4-dione

Systemtic Name: 1-methyl-3-[(2R)-2-thiophen-2-yl-3,5-dihydro-2H-1,5-benzothiazepin-4-ylidene]quinoline-2,4-dione Openeye Name: 1-methyl-3-[(2R)-2-(2-thienyl)-3,5-dihydro-2H-1,5-benzothiazepin-4-ylidene]quinoline-2,4-dione CAS Name: 1-methyl-3-[(2R)-2-thiophen-2-yl-3,5-dihydro-2H-1,5-benzothiazepin-4-ylidene]quinoline-2,4-dione IUPAC Name: 1-methyl-3-[(2R)-2-thiophen-2-yl-3,5-dihydro-2H-1,5-benzothiazepin-4-ylidene]quinoline-2,4-dione Traditional Name: 1-methyl-3-[(2R)-2-(2-thienyl)-3,5-dihydro-2H-1,5-benzothiazepin-4-ylidene]quinoline-2,4-quinone Formula: C23H18N2O2S2 MolecularWeight: 418.53122

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=CC=CC=C2C(=O)C(=C3CC(SC4=CC=CC=C4N3)C5=CC=CS5)C1=O

Isomeric SMILES

CN1C2=CC=CC=C2C(=O)C(=C3C[C@@H](SC4=CC=CC=C4N3)C5=CC=CS5)C1=O

InChI

InChI=1S/C23H18N2O2S2/c1-25-17-9-4-2-7-14(17)22(26)21(23(25)27)16-13-20(19-11-6-12-28-19)29-18-10-5-3-8-15(18)24-16/h2-12,20,24H,13H2,1H3/t20-/m1/s1