tert-butyl 2-[4-methyl-2-[(5-methylthiophen-2-yl)carbonylamino]pentyl]sulfanylethanoate

Systemtic Name: tert-butyl 2-[4-methyl-2-[(5-methylthiophen-2-yl)carbonylamino]pentyl]sulfanylethanoate Openeye Name: tert-butyl 2-[4-methyl-2-[(5-methylthiophene-2-carbonyl)amino]pentyl]sulfanylacetate CAS Name: 2-[[4-methyl-2-[[(5-methyl-2-thiophenyl)-oxomethyl]amino]pentyl]thio]acetic acid tert-butyl ester IUPAC Name: tert-butyl 2-[4-methyl-2-[(5-methylthiophene-2-carbonyl)amino]pentyl]sulfanylacetate Traditional Name: 2-[[4-methyl-2-[(5-methylthiophene-2-carbonyl)amino]pentyl]thio]acetic acid tert-butyl ester Formula: C18H29NO3S2 MolecularWeight: 371.55776

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(S1)C(=O)NC(CC(C)C)CSCC(=O)OC(C)(C)C

Isomeric SMILES

CC1=CC=C(S1)C(=O)NC(CC(C)C)CSCC(=O)OC(C)(C)C

InChI

InChI=1S/C18H29NO3S2/c1-12(2)9-14(10-23-11-16(20)22-18(4,5)6)19-17(21)15-8-7-13(3)24-15/h7-8,12,14H,9-11H2,1-6H3,(H,19,21)