N-[4-[[(3-azanyl-2,2-dimethyl-propyl)-(4-cyanophenyl)carbonyl-amino]methyl]phenyl]thiophene-2-carboxamide

Systemtic Name: N-[4-[[(3-azanyl-2,2-dimethyl-propyl)-(4-cyanophenyl)carbonyl-amino]methyl]phenyl]thiophene-2-carboxamide Openeye Name: N-[4-[[(3-amino-2,2-dimethyl-propyl)-(4-cyanobenzoyl)amino]methyl]phenyl]thiophene-2-carboxamide CAS Name: N-[4-[[(3-amino-2,2-dimethylpropyl)-[(4-cyanophenyl)-oxomethyl]amino]methyl]phenyl]-2-thiophenecarboxamide IUPAC Name: N-[4-[[(3-amino-2,2-dimethylpropyl)-(4-cyanobenzoyl)amino]methyl]phenyl]thiophene-2-carboxamide Traditional Name: N-[4-[[(3-amino-2,2-dimethyl-propyl)-(4-cyanobenzoyl)amino]methyl]phenyl]thiophene-2-carboxamide Formula: C25H26N4O2S MolecularWeight: 446.56454

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(CN)CN(CC1=CC=C(C=C1)NC(=O)C2=CC=CS2)C(=O)C3=CC=C(C=C3)C#N

Isomeric SMILES

CC(C)(CN)CN(CC1=CC=C(C=C1)NC(=O)C2=CC=CS2)C(=O)C3=CC=C(C=C3)C#N

InChI

InChI=1S/C25H26N4O2S/c1-25(2,16-27)17-29(24(31)20-9-5-18(14-26)6-10-20)15-19-7-11-21(12-8-19)28-23(30)22-4-3-13-32-22/h3-13H,15-17,27H2,1-2H3,(H,28,30)