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

Systemtic Name: 3-azanyl-N-(2-bromanyl-4-methyl-phenyl)-5-(3-chlorophenyl)imino-4-pyrrolidin-1-ylcarbonyl-2H-thiophene-2-carboxamide Openeye Name: 3-amino-N-(2-bromo-4-methyl-phenyl)-5-(3-chlorophenyl)imino-4-(pyrrolidine-1-carbonyl)-2H-thiophene-2-carboxamide CAS Name: 3-amino-N-(2-bromo-4-methylphenyl)-5-(3-chlorophenyl)imino-4-[oxo(1-pyrrolidinyl)methyl]-2H-thiophene-2-carboxamide IUPAC Name: 3-amino-N-(2-bromo-4-methylphenyl)-5-(3-chlorophenyl)imino-4-(pyrrolidine-1-carbonyl)-2H-thiophene-2-carboxamide Traditional Name: 3-amino-N-(2-bromo-4-methyl-phenyl)-5-(3-chlorophenyl)imino-4-(pyrrolidine-1-carbonyl)-2H-thiophene-2-carboxamide Formula: C23H22BrClN4O2S MolecularWeight: 533.86838

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C23H22BrClN4O2S/c1-13-7-8-17(16(24)11-13)28-21(30)20-19(26)18(23(31)29-9-2-3-10-29)22(32-20)27-15-6-4-5-14(25)12-15/h4-8,11-12,20H,2-3,9-10,26H2,1H3,(H,28,30)