N-[3-cyano-6-[(2-phenyl-1,3-thiazol-4-yl)methylamino]-4,5,6,7-tetrahydro-1-benzothiophen-2-yl]-2-ethyl-butanamide

Systemtic Name: N-[3-cyano-6-[(2-phenyl-1,3-thiazol-4-yl)methylamino]-4,5,6,7-tetrahydro-1-benzothiophen-2-yl]-2-ethyl-butanamide Openeye Name: N-[3-cyano-6-[(2-phenylthiazol-4-yl)methylamino]-4,5,6,7-tetrahydrobenzothiophen-2-yl]-2-ethyl-butanamide CAS Name: N-[3-cyano-6-[(2-phenyl-4-thiazolyl)methylamino]-4,5,6,7-tetrahydro-1-benzothiophen-2-yl]-2-ethylbutanamide IUPAC Name: N-[3-cyano-6-[(2-phenyl-1,3-thiazol-4-yl)methylamino]-4,5,6,7-tetrahydro-1-benzothiophen-2-yl]-2-ethylbutanamide Traditional Name: N-[3-cyano-6-[(2-phenylthiazol-4-yl)methylamino]-4,5,6,7-tetrahydrobenzothiophen-2-yl]-2-ethyl-butyramide Formula: C25H28N4OS2 MolecularWeight: 464.64602

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Descriptors Computed from Structure

Canonical SMILES:

CCC(CC)C(=O)NC1=C(C2=C(S1)CC(CC2)NCC3=CSC(=N3)C4=CC=CC=C4)C#N

Isomeric SMILES

CCC(CC)C(=O)NC1=C(C2=C(S1)CC(CC2)NCC3=CSC(=N3)C4=CC=CC=C4)C#N

InChI

InChI=1S/C25H28N4OS2/c1-3-16(4-2)23(30)29-25-21(13-26)20-11-10-18(12-22(20)32-25)27-14-19-15-31-24(28-19)17-8-6-5-7-9-17/h5-9,15-16,18,27H,3-4,10-12,14H2,1-2H3,(H,29,30)