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1-(4-ethoxy-3-pyrrolidin-1-ylsulfonyl-phenyl)-3-(phenylmethyl)thiourea
1-(4-ethoxy-3-pyrrolidin-1-ylsulfonyl-phenyl)-3-(phenylmethyl)thiourea
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Descriptors Computed from Structure
Canonical SMILES:
CCOC1=C(C=C(C=C1)NC(=S)NCC2=CC=CC=C2)S(=O)(=O)N3CCCC3
Isomeric SMILES
CCOC1=C(C=C(C=C1)NC(=S)NCC2=CC=CC=C2)S(=O)(=O)N3CCCC3
InChI
InChI=1S/C20H25N3O3S2/c1-2-26-18-11-10-17(14-19(18)28(24,25)23-12-6-7-13-23)22-20(27)21-15-16-8-4-3-5-9-16/h3-5,8-11,14H,2,6-7,12-13,15H2,1H3,(H2,21,22,27)
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