3-methyl-2-[(5-methyl-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)carbonylamino]pentanoic acid

Systemtic Name: 3-methyl-2-[(5-methyl-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)carbonylamino]pentanoic acid Openeye Name: 3-methyl-2-[(5-methyl-4,5,6,7-tetrahydrobenzothiophene-2-carbonyl)amino]pentanoic acid CAS Name: 3-methyl-2-[[(5-methyl-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)-oxomethyl]amino]pentanoic acid IUPAC Name: 3-methyl-2-[(5-methyl-4,5,6,7-tetrahydro-1-benzothiophene-2-carbonyl)amino]pentanoic acid Traditional Name: 3-methyl-2-[(5-methyl-4,5,6,7-tetrahydrobenzothiophene-2-carbonyl)amino]valeric acid Formula: C16H23NO3S MolecularWeight: 309.42372

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)C(C(=O)O)NC(=O)C1=CC2=C(S1)CCC(C2)C

Isomeric SMILES

CCC(C)C(C(=O)O)NC(=O)C1=CC2=C(S1)CCC(C2)C

InChI

InChI=1S/C16H23NO3S/c1-4-10(3)14(16(19)20)17-15(18)13-8-11-7-9(2)5-6-12(11)21-13/h8-10,14H,4-7H2,1-3H3,(H,17,18)(H,19,20)