1-[2-(4-methoxyphenyl)ethyl]-3-(4-pyrrolidin-1-ylsulfonylphenyl)thiourea

Systemtic Name: 1-[2-(4-methoxyphenyl)ethyl]-3-(4-pyrrolidin-1-ylsulfonylphenyl)thiourea Openeye Name: 1-[2-(4-methoxyphenyl)ethyl]-3-(4-pyrrolidin-1-ylsulfonylphenyl)thiourea CAS Name: 1-[2-(4-methoxyphenyl)ethyl]-3-[4-(1-pyrrolidinylsulfonyl)phenyl]thiourea IUPAC Name: 1-[2-(4-methoxyphenyl)ethyl]-3-(4-pyrrolidin-1-ylsulfonylphenyl)thiourea Traditional Name: 1-[2-(4-methoxyphenyl)ethyl]-3-(4-pyrrolidinosulfonylphenyl)thiourea Formula: C20H25N3O3S2 MolecularWeight: 419.5608

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)CCNC(=S)NC2=CC=C(C=C2)S(=O)(=O)N3CCCC3

Isomeric SMILES

COC1=CC=C(C=C1)CCNC(=S)NC2=CC=C(C=C2)S(=O)(=O)N3CCCC3

InChI

InChI=1S/C20H25N3O3S2/c1-26-18-8-4-16(5-9-18)12-13-21-20(27)22-17-6-10-19(11-7-17)28(24,25)23-14-2-3-15-23/h4-11H,2-3,12-15H2,1H3,(H2,21,22,27)