1-[(3-bromophenyl)methyl]-3-(4-morpholin-4-ylsulfonylphenyl)thiourea

Systemtic Name: 1-[(3-bromophenyl)methyl]-3-(4-morpholin-4-ylsulfonylphenyl)thiourea Openeye Name: 1-[(3-bromophenyl)methyl]-3-(4-morpholinosulfonylphenyl)thiourea CAS Name: 1-[(3-bromophenyl)methyl]-3-[4-(4-morpholinylsulfonyl)phenyl]thiourea IUPAC Name: 1-[(3-bromophenyl)methyl]-3-(4-morpholin-4-ylsulfonylphenyl)thiourea Traditional Name: 1-(3-bromobenzyl)-3-(4-morpholinosulfonylphenyl)thiourea Formula: C18H20BrN3O3S2 MolecularWeight: 470.4037

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Descriptors Computed from Structure

Canonical SMILES:

C1COCCN1S(=O)(=O)C2=CC=C(C=C2)NC(=S)NCC3=CC(=CC=C3)Br

Isomeric SMILES

C1COCCN1S(=O)(=O)C2=CC=C(C=C2)NC(=S)NCC3=CC(=CC=C3)Br

InChI

InChI=1S/C18H20BrN3O3S2/c19-15-3-1-2-14(12-15)13-20-18(26)21-16-4-6-17(7-5-16)27(23,24)22-8-10-25-11-9-22/h1-7,12H,8-11,13H2,(H2,20,21,26)