N-[2-[[[(2S)-1-cyclopentylpropan-2-yl]amino]methyl]phenyl]-5-methyl-thiophene-2-carboxamide

Systemtic Name: N-[2-[[[(2S)-1-cyclopentylpropan-2-yl]amino]methyl]phenyl]-5-methyl-thiophene-2-carboxamide Openeye Name: N-[2-[[[(1S)-2-cyclopentyl-1-methyl-ethyl]amino]methyl]phenyl]-5-methyl-thiophene-2-carboxamide CAS Name: N-[2-[[[(2S)-1-cyclopentylpropan-2-yl]amino]methyl]phenyl]-5-methyl-2-thiophenecarboxamide IUPAC Name: N-[2-[[[(2S)-1-cyclopentylpropan-2-yl]amino]methyl]phenyl]-5-methylthiophene-2-carboxamide Traditional Name: N-[2-[[[(1S)-2-cyclopentyl-1-methyl-ethyl]amino]methyl]phenyl]-5-methyl-thiophene-2-carboxamide Formula: C21H28N2OS MolecularWeight: 356.52482

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(S1)C(=O)NC2=CC=CC=C2CNC(C)CC3CCCC3

Isomeric SMILES

CC1=CC=C(S1)C(=O)NC2=CC=CC=C2CN[C@@H](C)CC3CCCC3

InChI

InChI=1S/C21H28N2OS/c1-15(13-17-7-3-4-8-17)22-14-18-9-5-6-10-19(18)23-21(24)20-12-11-16(2)25-20/h5-6,9-12,15,17,22H,3-4,7-8,13-14H2,1-2H3,(H,23,24)/t15-/m0/s1