4-(2-aminophenyl)sulfanyl-5-(4-tert-butylphenyl)sulfanyl-3,6-bis(3-methylbutoxy)benzene-1,2-dicarbonitrile

Systemtic Name: 4-(2-aminophenyl)sulfanyl-5-(4-tert-butylphenyl)sulfanyl-3,6-bis(3-methylbutoxy)benzene-1,2-dicarbonitrile Openeye Name: 4-(2-aminophenyl)sulfanyl-5-(4-tert-butylphenyl)sulfanyl-3,6-diisopentyloxy-phthalonitrile CAS Name: 4-[(2-aminophenyl)thio]-5-[(4-tert-butylphenyl)thio]-3,6-bis(3-methylbutoxy)benzene-1,2-dicarbonitrile IUPAC Name: 4-(2-aminophenyl)sulfanyl-5-(4-tert-butylphenyl)sulfanyl-3,6-bis(3-methylbutoxy)benzene-1,2-dicarbonitrile Traditional Name: 4-[(2-aminophenyl)thio]-5-[(4-tert-butylphenyl)thio]-3,6-diisoamoxy-phthalonitrile Formula: C34H41N3O2S2 MolecularWeight: 587.83824

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCOC1=C(C(=C(C(=C1C#N)C#N)OCCC(C)C)SC2=CC=CC=C2N)SC3=CC=C(C=C3)C(C)(C)C

Isomeric SMILES

CC(C)CCOC1=C(C(=C(C(=C1C#N)C#N)OCCC(C)C)SC2=CC=CC=C2N)SC3=CC=C(C=C3)C(C)(C)C

InChI

InChI=1S/C34H41N3O2S2/c1-22(2)16-18-38-30-26(20-35)27(21-36)31(39-19-17-23(3)4)33(41-29-11-9-8-10-28(29)37)32(30)40-25-14-12-24(13-15-25)34(5,6)7/h8-15,22-23H,16-19,37H2,1-7H3