1-pyridin-3-yl-3-(4-pyrrolidin-1-ylsulfonylphenyl)thiourea

Systemtic Name: 1-pyridin-3-yl-3-(4-pyrrolidin-1-ylsulfonylphenyl)thiourea Openeye Name: 1-(3-pyridyl)-3-(4-pyrrolidin-1-ylsulfonylphenyl)thiourea CAS Name: 1-(3-pyridinyl)-3-[4-(1-pyrrolidinylsulfonyl)phenyl]thiourea IUPAC Name: 1-pyridin-3-yl-3-(4-pyrrolidin-1-ylsulfonylphenyl)thiourea Traditional Name: 1-(3-pyridyl)-3-(4-pyrrolidinosulfonylphenyl)thiourea Formula: C16H18N4O2S2 MolecularWeight: 362.46972

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)S(=O)(=O)C2=CC=C(C=C2)NC(=S)NC3=CN=CC=C3

Isomeric SMILES

C1CCN(C1)S(=O)(=O)C2=CC=C(C=C2)NC(=S)NC3=CN=CC=C3

InChI

InChI=1S/C16H18N4O2S2/c21-24(22,20-10-1-2-11-20)15-7-5-13(6-8-15)18-16(23)19-14-4-3-9-17-12-14/h3-9,12H,1-2,10-11H2,(H2,18,19,23)