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

Systemtic Name: N-[4-[[4-[(4-azanylcyclohexyl)methyl]cyclohexyl]carbamoyl]-2-methyl-phenyl]-1-benzothiophene-2-carboxamide Openeye Name: N-[4-[[4-[(4-aminocyclohexyl)methyl]cyclohexyl]carbamoyl]-2-methyl-phenyl]benzothiophene-2-carboxamide CAS Name: N-[4-[[[4-[(4-aminocyclohexyl)methyl]cyclohexyl]amino]-oxomethyl]-2-methylphenyl]-1-benzothiophene-2-carboxamide IUPAC Name: N-[4-[[4-[(4-aminocyclohexyl)methyl]cyclohexyl]carbamoyl]-2-methylphenyl]-1-benzothiophene-2-carboxamide Traditional Name: N-[4-[[4-[(4-aminocyclohexyl)methyl]cyclohexyl]carbamoyl]-2-methyl-phenyl]benzothiophene-2-carboxamide Formula: C30H37N3O2S MolecularWeight: 503.69868

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)C(=O)NC2CCC(CC2)CC3CCC(CC3)N)NC(=O)C4=CC5=CC=CC=C5S4

Isomeric SMILES

CC1=C(C=CC(=C1)C(=O)NC2CCC(CC2)CC3CCC(CC3)N)NC(=O)C4=CC5=CC=CC=C5S4

InChI

InChI=1S/C30H37N3O2S/c1-19-16-23(10-15-26(19)33-30(35)28-18-22-4-2-3-5-27(22)36-28)29(34)32-25-13-8-21(9-14-25)17-20-6-11-24(31)12-7-20/h2-5,10,15-16,18,20-21,24-25H,6-9,11-14,17,31H2,1H3,(H,32,34)(H,33,35)