1-(4-ethoxy-3-pyrrolidin-1-ylsulfonyl-phenyl)-3-(2-methylprop-2-enyl)thiourea

Systemtic Name: 1-(4-ethoxy-3-pyrrolidin-1-ylsulfonyl-phenyl)-3-(2-methylprop-2-enyl)thiourea Openeye Name: 1-(4-ethoxy-3-pyrrolidin-1-ylsulfonyl-phenyl)-3-(2-methylallyl)thiourea CAS Name: 1-[4-ethoxy-3-(1-pyrrolidinylsulfonyl)phenyl]-3-(2-methylprop-2-enyl)thiourea IUPAC Name: 1-(4-ethoxy-3-pyrrolidin-1-ylsulfonylphenyl)-3-(2-methylprop-2-enyl)thiourea Traditional Name: 1-(4-ethoxy-3-pyrrolidinosulfonyl-phenyl)-3-(2-methylallyl)thiourea Formula: C17H25N3O3S2 MolecularWeight: 383.5287

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C=C1)NC(=S)NCC(=C)C)S(=O)(=O)N2CCCC2

Isomeric SMILES

CCOC1=C(C=C(C=C1)NC(=S)NCC(=C)C)S(=O)(=O)N2CCCC2

InChI

InChI=1S/C17H25N3O3S2/c1-4-23-15-8-7-14(19-17(24)18-12-13(2)3)11-16(15)25(21,22)20-9-5-6-10-20/h7-8,11H,2,4-6,9-10,12H2,1,3H3,(H2,18,19,24)