dimethyl 2-[2,2,6-trimethyl-3-(phenylmethyl)imino-1H-quinolin-4-ylidene]-1,3-dithiole-4,5-dicarboxylate

Systemtic Name: dimethyl 2-[2,2,6-trimethyl-3-(phenylmethyl)imino-1H-quinolin-4-ylidene]-1,3-dithiole-4,5-dicarboxylate Openeye Name: dimethyl 2-(3-benzylimino-2,2,6-trimethyl-1H-quinolin-4-ylidene)-1,3-dithiole-4,5-dicarboxylate CAS Name: 2-[2,2,6-trimethyl-3-(phenylmethyl)imino-1H-quinolin-4-ylidene]-1,3-dithiole-4,5-dicarboxylic acid dimethyl ester IUPAC Name: dimethyl 2-(3-benzylimino-2,2,6-trimethyl-1H-quinolin-4-ylidene)-1,3-dithiole-4,5-dicarboxylate Traditional Name: 2-(3-benzylimino-2,2,6-trimethyl-1H-quinolin-4-ylidene)-1,3-dithiole-4,5-dicarboxylic acid dimethyl ester Formula: C26H26N2O4S2 MolecularWeight: 494.62564

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)NC(C(=NCC3=CC=CC=C3)C2=C4SC(=C(S4)C(=O)OC)C(=O)OC)(C)C

Isomeric SMILES

CC1=CC2=C(C=C1)NC(C(=NCC3=CC=CC=C3)C2=C4SC(=C(S4)C(=O)OC)C(=O)OC)(C)C

InChI

InChI=1S/C26H26N2O4S2/c1-15-11-12-18-17(13-15)19(25-33-20(23(29)31-4)21(34-25)24(30)32-5)22(26(2,3)28-18)27-14-16-9-7-6-8-10-16/h6-13,28H,14H2,1-5H3