1-(2-methoxy-5-pyrrolidin-1-ylsulfonyl-phenyl)-3-phenyl-thiourea

Systemtic Name: 1-(2-methoxy-5-pyrrolidin-1-ylsulfonyl-phenyl)-3-phenyl-thiourea Openeye Name: 1-(2-methoxy-5-pyrrolidin-1-ylsulfonyl-phenyl)-3-phenyl-thiourea CAS Name: 1-[2-methoxy-5-(1-pyrrolidinylsulfonyl)phenyl]-3-phenylthiourea IUPAC Name: 1-(2-methoxy-5-pyrrolidin-1-ylsulfonylphenyl)-3-phenylthiourea Traditional Name: 1-(2-methoxy-5-pyrrolidinosulfonyl-phenyl)-3-phenyl-thiourea Formula: C18H21N3O3S2 MolecularWeight: 391.50764

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)S(=O)(=O)N2CCCC2)NC(=S)NC3=CC=CC=C3

Isomeric SMILES

COC1=C(C=C(C=C1)S(=O)(=O)N2CCCC2)NC(=S)NC3=CC=CC=C3

InChI

InChI=1S/C18H21N3O3S2/c1-24-17-10-9-15(26(22,23)21-11-5-6-12-21)13-16(17)20-18(25)19-14-7-3-2-4-8-14/h2-4,7-10,13H,5-6,11-12H2,1H3,(H2,19,20,25)