methyl 6-(2-aminophenyl)sulfanyl-6-(5-decylthiophen-2-yl)hexanoate

Systemtic Name: methyl 6-(2-aminophenyl)sulfanyl-6-(5-decylthiophen-2-yl)hexanoate Openeye Name: methyl 6-(2-aminophenyl)sulfanyl-6-(5-decyl-2-thienyl)hexanoate CAS Name: 6-[(2-aminophenyl)thio]-6-(5-decyl-2-thiophenyl)hexanoic acid methyl ester IUPAC Name: methyl 6-(2-aminophenyl)sulfanyl-6-(5-decylthiophen-2-yl)hexanoate Traditional Name: 6-[(2-aminophenyl)thio]-6-(5-decyl-2-thienyl)hexanoic acid methyl ester Formula: C27H41NO2S2 MolecularWeight: 475.74994

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCC1=CC=C(S1)C(CCCCC(=O)OC)SC2=CC=CC=C2N

Isomeric SMILES

CCCCCCCCCCC1=CC=C(S1)C(CCCCC(=O)OC)SC2=CC=CC=C2N

InChI

InChI=1S/C27H41NO2S2/c1-3-4-5-6-7-8-9-10-15-22-20-21-26(31-22)25(18-13-14-19-27(29)30-2)32-24-17-12-11-16-23(24)28/h11-12,16-17,20-21,25H,3-10,13-15,18-19,28H2,1-2H3