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

Systemtic Name: 1-[1-(4-bromophenyl)-2,5-bis(oxidanylidene)pyrrolidin-3-yl]-1-(furan-2-ylmethyl)-3-phenyl-thiourea Openeye Name: 1-[1-(4-bromophenyl)-2,5-dioxo-pyrrolidin-3-yl]-1-(2-furylmethyl)-3-phenyl-thiourea CAS Name: 1-[1-(4-bromophenyl)-2,5-dioxo-3-pyrrolidinyl]-1-(2-furanylmethyl)-3-phenylthiourea IUPAC Name: 1-[1-(4-bromophenyl)-2,5-dioxopyrrolidin-3-yl]-1-(furan-2-ylmethyl)-3-phenylthiourea Traditional Name: 1-[1-(4-bromophenyl)-2,5-diketo-pyrrolidin-3-yl]-1-(2-furfuryl)-3-phenyl-thiourea Formula: C22H18BrN3O3S MolecularWeight: 484.36562

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Descriptors Computed from Structure

Canonical SMILES:

C1C(C(=O)N(C1=O)C2=CC=C(C=C2)Br)N(CC3=CC=CO3)C(=S)NC4=CC=CC=C4

Isomeric SMILES

C1C(C(=O)N(C1=O)C2=CC=C(C=C2)Br)N(CC3=CC=CO3)C(=S)NC4=CC=CC=C4

InChI

InChI=1S/C22H18BrN3O3S/c23-15-8-10-17(11-9-15)26-20(27)13-19(21(26)28)25(14-18-7-4-12-29-18)22(30)24-16-5-2-1-3-6-16/h1-12,19H,13-14H2,(H,24,30)