4-(aminomethyl)-N-[1-[4-(3-azanyl-1H-indazol-6-yl)-5-chloranyl-thiophen-2-yl]-2-phenyl-ethyl]cyclohexane-1-carboxamide

Systemtic Name: 4-(aminomethyl)-N-[1-[4-(3-azanyl-1H-indazol-6-yl)-5-chloranyl-thiophen-2-yl]-2-phenyl-ethyl]cyclohexane-1-carboxamide Openeye Name: N-[1-[4-(3-amino-1H-indazol-6-yl)-5-chloro-2-thienyl]-2-phenyl-ethyl]-4-(aminomethyl)cyclohexanecarboxamide CAS Name: N-[1-[4-(3-amino-1H-indazol-6-yl)-5-chloro-2-thiophenyl]-2-phenylethyl]-4-(aminomethyl)-1-cyclohexanecarboxamide IUPAC Name: N-[1-[4-(3-amino-1H-indazol-6-yl)-5-chlorothiophen-2-yl]-2-phenylethyl]-4-(aminomethyl)cyclohexane-1-carboxamide Traditional Name: N-[1-[4-(3-amino-1H-indazol-6-yl)-5-chloro-2-thienyl]-2-phenyl-ethyl]-4-(aminomethyl)cyclohexanecarboxamide Formula: C27H30ClN5OS MolecularWeight: 508.078

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(CCC1CN)C(=O)NC(CC2=CC=CC=C2)C3=CC(=C(S3)Cl)C4=CC5=C(C=C4)C(=NN5)N

Isomeric SMILES

C1CC(CCC1CN)C(=O)NC(CC2=CC=CC=C2)C3=CC(=C(S3)Cl)C4=CC5=C(C=C4)C(=NN5)N

InChI

InChI=1S/C27H30ClN5OS/c28-25-21(19-10-11-20-22(13-19)32-33-26(20)30)14-24(35-25)23(12-16-4-2-1-3-5-16)31-27(34)18-8-6-17(15-29)7-9-18/h1-5,10-11,13-14,17-18,23H,6-9,12,15,29H2,(H,31,34)(H3,30,32,33)