1-(3-bromophenyl)-3-[1-(4,5-dimethyl-2-pyrrol-1-yl-thiophen-3-yl)ethyl]urea

Systemtic Name: 1-(3-bromophenyl)-3-[1-(4,5-dimethyl-2-pyrrol-1-yl-thiophen-3-yl)ethyl]urea Openeye Name: 1-(3-bromophenyl)-3-[1-(4,5-dimethyl-2-pyrrol-1-yl-3-thienyl)ethyl]urea CAS Name: 1-(3-bromophenyl)-3-[1-[4,5-dimethyl-2-(1-pyrrolyl)-3-thiophenyl]ethyl]urea IUPAC Name: 1-(3-bromophenyl)-3-[1-(4,5-dimethyl-2-pyrrol-1-ylthiophen-3-yl)ethyl]urea Traditional Name: 1-(3-bromophenyl)-3-[1-(4,5-dimethyl-2-pyrrol-1-yl-3-thienyl)ethyl]urea Formula: C19H20BrN3OS MolecularWeight: 418.3506

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC(=C1C(C)NC(=O)NC2=CC(=CC=C2)Br)N3C=CC=C3)C

Isomeric SMILES

CC1=C(SC(=C1C(C)NC(=O)NC2=CC(=CC=C2)Br)N3C=CC=C3)C

InChI

InChI=1S/C19H20BrN3OS/c1-12-14(3)25-18(23-9-4-5-10-23)17(12)13(2)21-19(24)22-16-8-6-7-15(20)11-16/h4-11,13H,1-3H3,(H2,21,22,24)