3-(2-chloranyl-5-morpholin-4-ylsulfonyl-phenyl)-1-(2-methoxyethyl)-1-(phenylmethyl)thiourea

Systemtic Name: 3-(2-chloranyl-5-morpholin-4-ylsulfonyl-phenyl)-1-(2-methoxyethyl)-1-(phenylmethyl)thiourea Openeye Name: 1-benzyl-3-(2-chloro-5-morpholinosulfonyl-phenyl)-1-(2-methoxyethyl)thiourea CAS Name: 3-[2-chloro-5-(4-morpholinylsulfonyl)phenyl]-1-(2-methoxyethyl)-1-(phenylmethyl)thiourea IUPAC Name: 1-benzyl-3-(2-chloro-5-morpholin-4-ylsulfonylphenyl)-1-(2-methoxyethyl)thiourea Traditional Name: 1-benzyl-3-(2-chloro-5-morpholinosulfonyl-phenyl)-1-(2-methoxyethyl)thiourea Formula: C21H26ClN3O4S2 MolecularWeight: 484.03184

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Descriptors Computed from Structure

Canonical SMILES:

COCCN(CC1=CC=CC=C1)C(=S)NC2=C(C=CC(=C2)S(=O)(=O)N3CCOCC3)Cl

Isomeric SMILES

COCCN(CC1=CC=CC=C1)C(=S)NC2=C(C=CC(=C2)S(=O)(=O)N3CCOCC3)Cl

InChI

InChI=1S/C21H26ClN3O4S2/c1-28-12-9-24(16-17-5-3-2-4-6-17)21(30)23-20-15-18(7-8-19(20)22)31(26,27)25-10-13-29-14-11-25/h2-8,15H,9-14,16H2,1H3,(H,23,30)