(2S)-N-(3-cyano-5,6,7,8-tetrahydro-4H-cyclohepta[b]thiophen-2-yl)-2-phenylazanyl-propanamide

Systemtic Name: (2S)-N-(3-cyano-5,6,7,8-tetrahydro-4H-cyclohepta[b]thiophen-2-yl)-2-phenylazanyl-propanamide Openeye Name: (2S)-2-anilino-N-(3-cyano-5,6,7,8-tetrahydro-4H-cyclohepta[b]thiophen-2-yl)propanamide CAS Name: (2S)-2-anilino-N-(3-cyano-5,6,7,8-tetrahydro-4H-cyclohepta[b]thiophen-2-yl)propanamide IUPAC Name: (2S)-2-anilino-N-(3-cyano-5,6,7,8-tetrahydro-4H-cyclohepta[b]thiophen-2-yl)propanamide Traditional Name: (2S)-2-anilino-N-(3-cyano-5,6,7,8-tetrahydro-4H-cyclohepta[b]thiophen-2-yl)propionamide Formula: C19H21N3OS MolecularWeight: 339.45454

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1=C(C2=C(S1)CCCCC2)C#N)NC3=CC=CC=C3

Isomeric SMILES

C[C@@H](C(=O)NC1=C(C2=C(S1)CCCCC2)C#N)NC3=CC=CC=C3

InChI

InChI=1S/C19H21N3OS/c1-13(21-14-8-4-2-5-9-14)18(23)22-19-16(12-20)15-10-6-3-7-11-17(15)24-19/h2,4-5,8-9,13,21H,3,6-7,10-11H2,1H3,(H,22,23)/t13-/m0/s1