(6S)-6-methyl-2-[[(2S)-2-phenylbutanoyl]amino]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide

Systemtic Name: (6S)-6-methyl-2-[[(2S)-2-phenylbutanoyl]amino]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide Openeye Name: (6S)-6-methyl-2-[[(2S)-2-phenylbutanoyl]amino]-4,5,6,7-tetrahydrobenzothiophene-3-carboxamide CAS Name: (6S)-6-methyl-2-[[(2S)-1-oxo-2-phenylbutyl]amino]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide IUPAC Name: (6S)-6-methyl-2-[[(2S)-2-phenylbutanoyl]amino]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide Traditional Name: (6S)-6-methyl-2-[[(2S)-2-phenylbutanoyl]amino]-4,5,6,7-tetrahydrobenzothiophene-3-carboxamide Formula: C20H24N2O2S MolecularWeight: 356.48176

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C1=CC=CC=C1)C(=O)NC2=C(C3=C(S2)CC(CC3)C)C(=O)N

Isomeric SMILES

CC[C@@H](C1=CC=CC=C1)C(=O)NC2=C(C3=C(S2)C[C@H](CC3)C)C(=O)N

InChI

InChI=1S/C20H24N2O2S/c1-3-14(13-7-5-4-6-8-13)19(24)22-20-17(18(21)23)15-10-9-12(2)11-16(15)25-20/h4-8,12,14H,3,9-11H2,1-2H3,(H2,21,23)(H,22,24)/t12-,14-/m0/s1