N-[5-[[4-[(4-azanylcyclohexyl)methyl]cyclohexyl]carbamoyl]-2-methoxy-phenyl]-1-benzothiophene-2-carboxamide

Systemtic Name: N-[5-[[4-[(4-azanylcyclohexyl)methyl]cyclohexyl]carbamoyl]-2-methoxy-phenyl]-1-benzothiophene-2-carboxamide Openeye Name: N-[5-[[4-[(4-aminocyclohexyl)methyl]cyclohexyl]carbamoyl]-2-methoxy-phenyl]benzothiophene-2-carboxamide CAS Name: N-[5-[[[4-[(4-aminocyclohexyl)methyl]cyclohexyl]amino]-oxomethyl]-2-methoxyphenyl]-1-benzothiophene-2-carboxamide IUPAC Name: N-[5-[[4-[(4-aminocyclohexyl)methyl]cyclohexyl]carbamoyl]-2-methoxyphenyl]-1-benzothiophene-2-carboxamide Traditional Name: N-[5-[[4-[(4-aminocyclohexyl)methyl]cyclohexyl]carbamoyl]-2-methoxy-phenyl]benzothiophene-2-carboxamide Formula: C30H37N3O3S MolecularWeight: 519.69808

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C(=O)NC2CCC(CC2)CC3CCC(CC3)N)NC(=O)C4=CC5=CC=CC=C5S4

Isomeric SMILES

COC1=C(C=C(C=C1)C(=O)NC2CCC(CC2)CC3CCC(CC3)N)NC(=O)C4=CC5=CC=CC=C5S4

InChI

InChI=1S/C30H37N3O3S/c1-36-26-15-10-22(17-25(26)33-30(35)28-18-21-4-2-3-5-27(21)37-28)29(34)32-24-13-8-20(9-14-24)16-19-6-11-23(31)12-7-19/h2-5,10,15,17-20,23-24H,6-9,11-14,16,31H2,1H3,(H,32,34)(H,33,35)