1-(phenylmethyl)-3-[4-(2-pyridin-3-ylpiperidin-1-yl)sulfonylphenyl]thiourea

Systemtic Name: 1-(phenylmethyl)-3-[4-(2-pyridin-3-ylpiperidin-1-yl)sulfonylphenyl]thiourea Openeye Name: 1-benzyl-3-[4-[[2-(3-pyridyl)-1-piperidyl]sulfonyl]phenyl]thiourea CAS Name: 1-(phenylmethyl)-3-[4-[[2-(3-pyridinyl)-1-piperidinyl]sulfonyl]phenyl]thiourea IUPAC Name: 1-benzyl-3-[4-(2-pyridin-3-ylpiperidin-1-yl)sulfonylphenyl]thiourea Traditional Name: 1-benzyl-3-[4-[2-(3-pyridyl)piperidino]sulfonylphenyl]thiourea Formula: C24H26N4O2S2 MolecularWeight: 466.61884

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C(C1)C2=CN=CC=C2)S(=O)(=O)C3=CC=C(C=C3)NC(=S)NCC4=CC=CC=C4

Isomeric SMILES

C1CCN(C(C1)C2=CN=CC=C2)S(=O)(=O)C3=CC=C(C=C3)NC(=S)NCC4=CC=CC=C4

InChI

InChI=1S/C24H26N4O2S2/c29-32(30,28-16-5-4-10-23(28)20-9-6-15-25-18-20)22-13-11-21(12-14-22)27-24(31)26-17-19-7-2-1-3-8-19/h1-3,6-9,11-15,18,23H,4-5,10,16-17H2,(H2,26,27,31)