3-chloranyl-N-[4-(propylamino)cyclohexyl]-N-[(3-pyridin-4-ylphenyl)methyl]-1-benzothiophene-2-carboxamide

Systemtic Name: 3-chloranyl-N-[4-(propylamino)cyclohexyl]-N-[(3-pyridin-4-ylphenyl)methyl]-1-benzothiophene-2-carboxamide Openeye Name: 3-chloro-N-[4-(propylamino)cyclohexyl]-N-[[3-(4-pyridyl)phenyl]methyl]benzothiophene-2-carboxamide CAS Name: 3-chloro-N-[4-(propylamino)cyclohexyl]-N-[(3-pyridin-4-ylphenyl)methyl]-1-benzothiophene-2-carboxamide IUPAC Name: 3-chloro-N-[4-(propylamino)cyclohexyl]-N-[(3-pyridin-4-ylphenyl)methyl]-1-benzothiophene-2-carboxamide Traditional Name: 3-chloro-N-[4-(propylamino)cyclohexyl]-N-[3-(4-pyridyl)benzyl]benzothiophene-2-carboxamide Formula: C30H32ClN3OS MolecularWeight: 518.11258

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Descriptors Computed from Structure

Canonical SMILES:

CCCNC1CCC(CC1)N(CC2=CC=CC(=C2)C3=CC=NC=C3)C(=O)C4=C(C5=CC=CC=C5S4)Cl

Isomeric SMILES

CCCNC1CCC(CC1)N(CC2=CC=CC(=C2)C3=CC=NC=C3)C(=O)C4=C(C5=CC=CC=C5S4)Cl

InChI

InChI=1S/C30H32ClN3OS/c1-2-16-33-24-10-12-25(13-11-24)34(30(35)29-28(31)26-8-3-4-9-27(26)36-29)20-21-6-5-7-23(19-21)22-14-17-32-18-15-22/h3-9,14-15,17-19,24-25,33H,2,10-13,16,20H2,1H3