2-[(3-azanyl-2,2-dimethyl-propyl)amino]-4-phenyl-5-(phenylcarbonyl)thiophene-3-carbonitrile

Systemtic Name: 2-[(3-azanyl-2,2-dimethyl-propyl)amino]-4-phenyl-5-(phenylcarbonyl)thiophene-3-carbonitrile Openeye Name: 2-[(3-amino-2,2-dimethyl-propyl)amino]-5-benzoyl-4-phenyl-thiophene-3-carbonitrile CAS Name: 2-[(3-amino-2,2-dimethylpropyl)amino]-5-benzoyl-4-phenyl-3-thiophenecarbonitrile IUPAC Name: 2-[(3-amino-2,2-dimethylpropyl)amino]-5-benzoyl-4-phenylthiophene-3-carbonitrile Traditional Name: 2-[(3-amino-2,2-dimethyl-propyl)amino]-5-benzoyl-4-phenyl-thiophene-3-carbonitrile Formula: C23H23N3OS MolecularWeight: 389.51322

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)(CN)CNC1=C(C(=C(S1)C(=O)C2=CC=CC=C2)C3=CC=CC=C3)C#N

Isomeric SMILES

CC(C)(CN)CNC1=C(C(=C(S1)C(=O)C2=CC=CC=C2)C3=CC=CC=C3)C#N

InChI

InChI=1S/C23H23N3OS/c1-23(2,14-25)15-26-22-18(13-24)19(16-9-5-3-6-10-16)21(28-22)20(27)17-11-7-4-8-12-17/h3-12,26H,14-15,25H2,1-2H3