1-(4-ethoxy-3-pyrrolidin-1-ylsulfonyl-phenyl)-3-propan-2-yl-thiourea

Systemtic Name: 1-(4-ethoxy-3-pyrrolidin-1-ylsulfonyl-phenyl)-3-propan-2-yl-thiourea Openeye Name: 1-(4-ethoxy-3-pyrrolidin-1-ylsulfonyl-phenyl)-3-isopropyl-thiourea CAS Name: 1-[4-ethoxy-3-(1-pyrrolidinylsulfonyl)phenyl]-3-propan-2-ylthiourea IUPAC Name: 1-(4-ethoxy-3-pyrrolidin-1-ylsulfonylphenyl)-3-propan-2-ylthiourea Traditional Name: 1-(4-ethoxy-3-pyrrolidinosulfonyl-phenyl)-3-isopropyl-thiourea Formula: C16H25N3O3S2 MolecularWeight: 371.518

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H25N3O3S2/c1-4-22-14-8-7-13(18-16(23)17-12(2)3)11-15(14)24(20,21)19-9-5-6-10-19/h7-8,11-12H,4-6,9-10H2,1-3H3,(H2,17,18,23)