N-(4-cyanophenyl)-4-[(3S)-3-methylpiperidin-1-yl]sulfonyl-thiophene-2-carboxamide

Systemtic Name: N-(4-cyanophenyl)-4-[(3S)-3-methylpiperidin-1-yl]sulfonyl-thiophene-2-carboxamide Openeye Name: N-(4-cyanophenyl)-4-[[(3S)-3-methyl-1-piperidyl]sulfonyl]thiophene-2-carboxamide CAS Name: N-(4-cyanophenyl)-4-[[(3S)-3-methyl-1-piperidinyl]sulfonyl]-2-thiophenecarboxamide IUPAC Name: N-(4-cyanophenyl)-4-[(3S)-3-methylpiperidin-1-yl]sulfonylthiophene-2-carboxamide Traditional Name: N-(4-cyanophenyl)-4-[(3S)-3-methylpiperidino]sulfonyl-thiophene-2-carboxamide Formula: C18H19N3O3S2 MolecularWeight: 389.49176

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1CCCN(C1)S(=O)(=O)C2=CSC(=C2)C(=O)NC3=CC=C(C=C3)C#N

Isomeric SMILES

C[C@H]1CCCN(C1)S(=O)(=O)C2=CSC(=C2)C(=O)NC3=CC=C(C=C3)C#N

InChI

InChI=1S/C18H19N3O3S2/c1-13-3-2-8-21(11-13)26(23,24)16-9-17(25-12-16)18(22)20-15-6-4-14(10-19)5-7-15/h4-7,9,12-13H,2-3,8,11H2,1H3,(H,20,22)/t13-/m0/s1