N-[1-[4-[(4-cyanophenyl)methyl]piperazin-1-yl]-3-methyl-1-oxidanylidene-butan-2-yl]thiophene-2-carboxamide

Systemtic Name: N-[1-[4-[(4-cyanophenyl)methyl]piperazin-1-yl]-3-methyl-1-oxidanylidene-butan-2-yl]thiophene-2-carboxamide Openeye Name: N-[1-[4-[(4-cyanophenyl)methyl]piperazine-1-carbonyl]-2-methyl-propyl]thiophene-2-carboxamide CAS Name: N-[1-[4-[(4-cyanophenyl)methyl]-1-piperazinyl]-3-methyl-1-oxobutan-2-yl]-2-thiophenecarboxamide IUPAC Name: N-[1-[4-[(4-cyanophenyl)methyl]piperazin-1-yl]-3-methyl-1-oxobutan-2-yl]thiophene-2-carboxamide Traditional Name: N-[1-[4-(4-cyanobenzyl)piperazine-1-carbonyl]-2-methyl-propyl]thiophene-2-carboxamide Formula: C22H26N4O2S MolecularWeight: 410.53244

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C(=O)N1CCN(CC1)CC2=CC=C(C=C2)C#N)NC(=O)C3=CC=CS3

Isomeric SMILES

CC(C)C(C(=O)N1CCN(CC1)CC2=CC=C(C=C2)C#N)NC(=O)C3=CC=CS3

InChI

InChI=1S/C22H26N4O2S/c1-16(2)20(24-21(27)19-4-3-13-29-19)22(28)26-11-9-25(10-12-26)15-18-7-5-17(14-23)6-8-18/h3-8,13,16,20H,9-12,15H2,1-2H3,(H,24,27)