N-(2-aminocarbonyl-4-chloranyl-phenyl)-4,5-bis(1-azanylbutyl)-3-chloranyl-thiophene-2-carboxamide

Systemtic Name: N-(2-aminocarbonyl-4-chloranyl-phenyl)-4,5-bis(1-azanylbutyl)-3-chloranyl-thiophene-2-carboxamide Openeye Name: 4,5-bis(1-aminobutyl)-N-(2-carbamoyl-4-chloro-phenyl)-3-chloro-thiophene-2-carboxamide CAS Name: 4,5-bis(1-aminobutyl)-N-(2-carbamoyl-4-chlorophenyl)-3-chloro-2-thiophenecarboxamide IUPAC Name: 4,5-bis(1-aminobutyl)-N-(2-carbamoyl-4-chlorophenyl)-3-chlorothiophene-2-carboxamide Traditional Name: 4,5-bis(1-aminobutyl)-N-(2-carbamoyl-4-chloro-phenyl)-3-chloro-thiophene-2-carboxamide Formula: C20H26Cl2N4O2S MolecularWeight: 457.41704

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(C1=C(SC(=C1Cl)C(=O)NC2=C(C=C(C=C2)Cl)C(=O)N)C(CCC)N)N

Isomeric SMILES

CCCC(C1=C(SC(=C1Cl)C(=O)NC2=C(C=C(C=C2)Cl)C(=O)N)C(CCC)N)N

InChI

InChI=1S/C20H26Cl2N4O2S/c1-3-5-12(23)15-16(22)18(29-17(15)13(24)6-4-2)20(28)26-14-8-7-10(21)9-11(14)19(25)27/h7-9,12-13H,3-6,23-24H2,1-2H3,(H2,25,27)(H,26,28)