tert-butyl 2-(4,5-dimethyl-1,3-dithiol-2-ylidene)-4,6-dimethyl-[1,3]dithiolo[4,5-c]pyrrole-5-carboxylate

Systemtic Name: tert-butyl 2-(4,5-dimethyl-1,3-dithiol-2-ylidene)-4,6-dimethyl-[1,3]dithiolo[4,5-c]pyrrole-5-carboxylate Openeye Name: tert-butyl 2-(4,5-dimethyl-1,3-dithiol-2-ylidene)-4,6-dimethyl-[1,3]dithiolo[4,5-c]pyrrole-5-carboxylate CAS Name: 2-(4,5-dimethyl-1,3-dithiol-2-ylidene)-4,6-dimethyl-[1,3]dithiolo[4,5-c]pyrrole-5-carboxylic acid tert-butyl ester IUPAC Name: tert-butyl 2-(4,5-dimethyl-1,3-dithiol-2-ylidene)-4,6-dimethyl-[1,3]dithiolo[4,5-c]pyrrole-5-carboxylate Traditional Name: 2-(4,5-dimethyl-1,3-dithiol-2-ylidene)-4,6-dimethyl-[1,3]dithiolo[4,5-c]pyrrole-5-carboxylic acid tert-butyl ester Formula: C17H21NO2S4 MolecularWeight: 399.61414

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C2C(=C(N1C(=O)OC(C)(C)C)C)SC(=C3SC(=C(S3)C)C)S2

Isomeric SMILES

CC1=C2C(=C(N1C(=O)OC(C)(C)C)C)SC(=C3SC(=C(S3)C)C)S2

InChI

InChI=1S/C17H21NO2S4/c1-8-12-13(9(2)18(8)16(19)20-17(5,6)7)24-15(23-12)14-21-10(3)11(4)22-14/h1-7H3