1-(4-piperidin-1-ylsulfonylphenyl)-3-(pyridin-4-ylmethyl)thiourea

Systemtic Name: 1-(4-piperidin-1-ylsulfonylphenyl)-3-(pyridin-4-ylmethyl)thiourea Openeye Name: 1-[4-(1-piperidylsulfonyl)phenyl]-3-(4-pyridylmethyl)thiourea CAS Name: 1-[4-(1-piperidinylsulfonyl)phenyl]-3-(pyridin-4-ylmethyl)thiourea IUPAC Name: 1-(4-piperidin-1-ylsulfonylphenyl)-3-(pyridin-4-ylmethyl)thiourea Traditional Name: 1-(4-piperidinosulfonylphenyl)-3-(4-pyridylmethyl)thiourea Formula: C18H22N4O2S2 MolecularWeight: 390.52288

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)S(=O)(=O)C2=CC=C(C=C2)NC(=S)NCC3=CC=NC=C3

Isomeric SMILES

C1CCN(CC1)S(=O)(=O)C2=CC=C(C=C2)NC(=S)NCC3=CC=NC=C3

InChI

InChI=1S/C18H22N4O2S2/c23-26(24,22-12-2-1-3-13-22)17-6-4-16(5-7-17)21-18(25)20-14-15-8-10-19-11-9-15/h4-11H,1-3,12-14H2,(H2,20,21,25)