N-[2-[[3-azanylpropyl(cyclohexylcarbonyl)amino]methyl]phenyl]thiophene-2-carboxamide

Systemtic Name: N-[2-[[3-azanylpropyl(cyclohexylcarbonyl)amino]methyl]phenyl]thiophene-2-carboxamide Openeye Name: N-[2-[[3-aminopropyl(cyclohexanecarbonyl)amino]methyl]phenyl]thiophene-2-carboxamide CAS Name: N-[2-[[3-aminopropyl-[cyclohexyl(oxo)methyl]amino]methyl]phenyl]-2-thiophenecarboxamide IUPAC Name: N-[2-[[3-aminopropyl(cyclohexanecarbonyl)amino]methyl]phenyl]thiophene-2-carboxamide Traditional Name: N-[2-[[3-aminopropyl(cyclohexanecarbonyl)amino]methyl]phenyl]thiophene-2-carboxamide Formula: C22H29N3O2S MolecularWeight: 399.54956

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)C(=O)N(CCCN)CC2=CC=CC=C2NC(=O)C3=CC=CS3

Isomeric SMILES

C1CCC(CC1)C(=O)N(CCCN)CC2=CC=CC=C2NC(=O)C3=CC=CS3

InChI

InChI=1S/C22H29N3O2S/c23-13-7-14-25(22(27)17-8-2-1-3-9-17)16-18-10-4-5-11-19(18)24-21(26)20-12-6-15-28-20/h4-6,10-12,15,17H,1-3,7-9,13-14,16,23H2,(H,24,26)