(2R)-3-azanyl-N-(4-bromanyl-3-methyl-phenyl)-5-(4-fluorophenyl)imino-4-pyrrolidin-1-ylcarbonyl-2H-thiophene-2-carboxamide

Systemtic Name: (2R)-3-azanyl-N-(4-bromanyl-3-methyl-phenyl)-5-(4-fluorophenyl)imino-4-pyrrolidin-1-ylcarbonyl-2H-thiophene-2-carboxamide Openeye Name: (2R)-3-amino-N-(4-bromo-3-methyl-phenyl)-5-(4-fluorophenyl)imino-4-(pyrrolidine-1-carbonyl)-2H-thiophene-2-carboxamide CAS Name: (2R)-3-amino-N-(4-bromo-3-methylphenyl)-5-(4-fluorophenyl)imino-4-[oxo(1-pyrrolidinyl)methyl]-2H-thiophene-2-carboxamide IUPAC Name: (2R)-3-amino-N-(4-bromo-3-methylphenyl)-5-(4-fluorophenyl)imino-4-(pyrrolidine-1-carbonyl)-2H-thiophene-2-carboxamide Traditional Name: (2R)-3-amino-N-(4-bromo-3-methyl-phenyl)-5-(4-fluorophenyl)imino-4-(pyrrolidine-1-carbonyl)-2H-thiophene-2-carboxamide Formula: C23H22BrFN4O2S MolecularWeight: 517.413783

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)NC(=O)C2C(=C(C(=NC3=CC=C(C=C3)F)S2)C(=O)N4CCCC4)N)Br

Isomeric SMILES

CC1=C(C=CC(=C1)NC(=O)[C@H]2C(=C(C(=NC3=CC=C(C=C3)F)S2)C(=O)N4CCCC4)N)Br

InChI

InChI=1S/C23H22BrFN4O2S/c1-13-12-16(8-9-17(13)24)27-21(30)20-19(26)18(23(31)29-10-2-3-11-29)22(32-20)28-15-6-4-14(25)5-7-15/h4-9,12,20H,2-3,10-11,26H2,1H3,(H,27,30)/t20-/m1/s1