N-[1,1-bis(oxidanylidene)-2,3-dihydrothiophen-3-yl]-1-(4-pyrazol-1-ylphenyl)piperidin-4-amine

Systemtic Name: N-[1,1-bis(oxidanylidene)-2,3-dihydrothiophen-3-yl]-1-(4-pyrazol-1-ylphenyl)piperidin-4-amine Openeye Name: N-(1,1-dioxo-2,3-dihydrothiophen-3-yl)-1-(4-pyrazol-1-ylphenyl)piperidin-4-amine CAS Name: N-(1,1-dioxo-2,3-dihydrothiophen-3-yl)-1-[4-(1-pyrazolyl)phenyl]-4-piperidinamine IUPAC Name: N-(1,1-dioxo-2,3-dihydrothiophen-3-yl)-1-(4-pyrazol-1-ylphenyl)piperidin-4-amine Traditional Name: (1,1-diketo-2,3-dihydrothiophen-3-yl)-[1-(4-pyrazol-1-ylphenyl)-4-piperidyl]amine Formula: C18H22N4O2S MolecularWeight: 358.45788

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1NC2CS(=O)(=O)C=C2)C3=CC=C(C=C3)N4C=CC=N4

Isomeric SMILES

C1CN(CCC1NC2CS(=O)(=O)C=C2)C3=CC=C(C=C3)N4C=CC=N4

InChI

InChI=1S/C18H22N4O2S/c23-25(24)13-8-16(14-25)20-15-6-11-21(12-7-15)17-2-4-18(5-3-17)22-10-1-9-19-22/h1-5,8-10,13,15-16,20H,6-7,11-12,14H2