1-[1-(4-bromophenyl)-2,5-bis(oxidanylidene)pyrrolidin-3-yl]-1-phenethyl-3-phenyl-thiourea

Systemtic Name: 1-[1-(4-bromophenyl)-2,5-bis(oxidanylidene)pyrrolidin-3-yl]-1-phenethyl-3-phenyl-thiourea Openeye Name: 1-[1-(4-bromophenyl)-2,5-dioxo-pyrrolidin-3-yl]-1-phenethyl-3-phenyl-thiourea CAS Name: 1-[1-(4-bromophenyl)-2,5-dioxo-3-pyrrolidinyl]-1-phenethyl-3-phenylthiourea IUPAC Name: 1-[1-(4-bromophenyl)-2,5-dioxopyrrolidin-3-yl]-1-phenethyl-3-phenylthiourea Traditional Name: 1-[1-(4-bromophenyl)-2,5-diketo-pyrrolidin-3-yl]-1-phenethyl-3-phenyl-thiourea Formula: C25H22BrN3O2S MolecularWeight: 508.43008

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Descriptors Computed from Structure

Canonical SMILES:

C1C(C(=O)N(C1=O)C2=CC=C(C=C2)Br)N(CCC3=CC=CC=C3)C(=S)NC4=CC=CC=C4

Isomeric SMILES

C1C(C(=O)N(C1=O)C2=CC=C(C=C2)Br)N(CCC3=CC=CC=C3)C(=S)NC4=CC=CC=C4

InChI

InChI=1S/C25H22BrN3O2S/c26-19-11-13-21(14-12-19)29-23(30)17-22(24(29)31)28(16-15-18-7-3-1-4-8-18)25(32)27-20-9-5-2-6-10-20/h1-14,22H,15-17H2,(H,27,32)