N-[(2S)-1-azanyl-3-cyclohexyl-propan-2-yl]-5-(1H-pyrrolo[2,3-b]pyridin-4-yl)thiophene-2-carboxamide

Systemtic Name: N-[(2S)-1-azanyl-3-cyclohexyl-propan-2-yl]-5-(1H-pyrrolo[2,3-b]pyridin-4-yl)thiophene-2-carboxamide Openeye Name: N-[(1S)-1-(aminomethyl)-2-cyclohexyl-ethyl]-5-(1H-pyrrolo[2,3-b]pyridin-4-yl)thiophene-2-carboxamide CAS Name: N-[(2S)-1-amino-3-cyclohexylpropan-2-yl]-5-(1H-pyrrolo[2,3-b]pyridin-4-yl)-2-thiophenecarboxamide IUPAC Name: N-[(2S)-1-amino-3-cyclohexylpropan-2-yl]-5-(1H-pyrrolo[2,3-b]pyridin-4-yl)thiophene-2-carboxamide Traditional Name: N-[(1S)-1-(aminomethyl)-2-cyclohexyl-ethyl]-5-(1H-pyrrolo[2,3-b]pyridin-4-yl)thiophene-2-carboxamide Formula: C21H26N4OS MolecularWeight: 382.52234

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)CC(CN)NC(=O)C2=CC=C(S2)C3=C4C=CNC4=NC=C3

Isomeric SMILES

C1CCC(CC1)C[C@@H](CN)NC(=O)C2=CC=C(S2)C3=C4C=CNC4=NC=C3

InChI

InChI=1S/C21H26N4OS/c22-13-15(12-14-4-2-1-3-5-14)25-21(26)19-7-6-18(27-19)16-8-10-23-20-17(16)9-11-24-20/h6-11,14-15H,1-5,12-13,22H2,(H,23,24)(H,25,26)/t15-/m0/s1