1-methyl-3-(4-pyrrolidin-1-ylsulfonylphenyl)thiourea

Systemtic Name: 1-methyl-3-(4-pyrrolidin-1-ylsulfonylphenyl)thiourea Openeye Name: 1-methyl-3-(4-pyrrolidin-1-ylsulfonylphenyl)thiourea CAS Name: 1-methyl-3-[4-(1-pyrrolidinylsulfonyl)phenyl]thiourea IUPAC Name: 1-methyl-3-(4-pyrrolidin-1-ylsulfonylphenyl)thiourea Traditional Name: 1-methyl-3-(4-pyrrolidinosulfonylphenyl)thiourea Formula: C12H17N3O2S2 MolecularWeight: 299.41228

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Descriptors Computed from Structure

Canonical SMILES:

CNC(=S)NC1=CC=C(C=C1)S(=O)(=O)N2CCCC2

Isomeric SMILES

CNC(=S)NC1=CC=C(C=C1)S(=O)(=O)N2CCCC2

InChI

InChI=1S/C12H17N3O2S2/c1-13-12(18)14-10-4-6-11(7-5-10)19(16,17)15-8-2-3-9-15/h4-7H,2-3,8-9H2,1H3,(H2,13,14,18)