2-[[(2R)-2-phenylbutanoyl]amino]-5,6,7,8-tetrahydro-4H-cyclohepta[b]thiophene-3-carboxamide

Systemtic Name: 2-[[(2R)-2-phenylbutanoyl]amino]-5,6,7,8-tetrahydro-4H-cyclohepta[b]thiophene-3-carboxamide Openeye Name: 2-[[(2R)-2-phenylbutanoyl]amino]-5,6,7,8-tetrahydro-4H-cyclohepta[b]thiophene-3-carboxamide CAS Name: 2-[[(2R)-1-oxo-2-phenylbutyl]amino]-5,6,7,8-tetrahydro-4H-cyclohepta[b]thiophene-3-carboxamide IUPAC Name: 2-[[(2R)-2-phenylbutanoyl]amino]-5,6,7,8-tetrahydro-4H-cyclohepta[b]thiophene-3-carboxamide Traditional Name: 2-[[(2R)-2-phenylbutanoyl]amino]-5,6,7,8-tetrahydro-4H-cyclohepta[b]thiophene-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)CCCCC3)C(=O)N

Isomeric SMILES

CC[C@H](C1=CC=CC=C1)C(=O)NC2=C(C3=C(S2)CCCCC3)C(=O)N

InChI

InChI=1S/C20H24N2O2S/c1-2-14(13-9-5-3-6-10-13)19(24)22-20-17(18(21)23)15-11-7-4-8-12-16(15)25-20/h3,5-6,9-10,14H,2,4,7-8,11-12H2,1H3,(H2,21,23)(H,22,24)/t14-/m1/s1