3-methyl-3-sulfanyl-4-[2-[2-(1,2,3,4-tetrahydronaphthalen-1-ylcarbonylamino)ethyl]phenyl]butanoate

Systemtic Name: 3-methyl-3-sulfanyl-4-[2-[2-(1,2,3,4-tetrahydronaphthalen-1-ylcarbonylamino)ethyl]phenyl]butanoate Openeye Name: 3-methyl-3-sulfanyl-4-[2-[2-(tetralin-1-carbonylamino)ethyl]phenyl]butanoate CAS Name: 3-mercapto-3-methyl-4-[2-[2-[[oxo(1,2,3,4-tetrahydronaphthalen-1-yl)methyl]amino]ethyl]phenyl]butanoate IUPAC Name: 3-methyl-3-sulfanyl-4-[2-[2-(1,2,3,4-tetrahydronaphthalene-1-carbonylamino)ethyl]phenyl]butanoate Traditional Name: 3-mercapto-3-methyl-4-[2-[2-(tetralin-1-carbonylamino)ethyl]phenyl]butyrate Formula: C24H28NO3S- MolecularWeight: 410.54902

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Descriptors Computed from Structure

Canonical SMILES:

CC(CC1=CC=CC=C1CCNC(=O)C2CCCC3=CC=CC=C23)(CC(=O)[O-])S

Isomeric SMILES

CC(CC1=CC=CC=C1CCNC(=O)C2CCCC3=CC=CC=C23)(CC(=O)[O-])S

InChI

InChI=1S/C24H29NO3S/c1-24(29,16-22(26)27)15-19-9-3-2-7-17(19)13-14-25-23(28)21-12-6-10-18-8-4-5-11-20(18)21/h2-5,7-9,11,21,29H,6,10,12-16H2,1H3,(H,25,28)(H,26,27)/p-1