N-[[2-(3-azanyl-6-thiophen-2-yl-thieno[2,3-b]pyridin-2-yl)carbonyl-3,4-dihydro-1H-isoquinolin-1-yl]methyl]cyclohexanecarboxamide

Systemtic Name: N-[[2-(3-azanyl-6-thiophen-2-yl-thieno[2,3-b]pyridin-2-yl)carbonyl-3,4-dihydro-1H-isoquinolin-1-yl]methyl]cyclohexanecarboxamide Openeye Name: N-[[2-[3-amino-6-(2-thienyl)thieno[2,3-b]pyridine-2-carbonyl]-3,4-dihydro-1H-isoquinolin-1-yl]methyl]cyclohexanecarboxamide CAS Name: N-[[2-[(3-amino-6-thiophen-2-yl-2-thieno[2,3-b]pyridinyl)-oxomethyl]-3,4-dihydro-1H-isoquinolin-1-yl]methyl]cyclohexanecarboxamide IUPAC Name: N-[[2-(3-amino-6-thiophen-2-ylthieno[2,3-b]pyridine-2-carbonyl)-3,4-dihydro-1H-isoquinolin-1-yl]methyl]cyclohexanecarboxamide Traditional Name: N-[[2-[3-amino-6-(2-thienyl)thieno[2,3-b]pyridine-2-carbonyl]-3,4-dihydro-1H-isoquinolin-1-yl]methyl]cyclohexanecarboxamide Formula: C29H30N4O2S2 MolecularWeight: 530.7041

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)C(=O)NCC2C3=CC=CC=C3CCN2C(=O)C4=C(C5=C(S4)N=C(C=C5)C6=CC=CS6)N

Isomeric SMILES

C1CCC(CC1)C(=O)NCC2C3=CC=CC=C3CCN2C(=O)C4=C(C5=C(S4)N=C(C=C5)C6=CC=CS6)N

InChI

InChI=1S/C29H30N4O2S2/c30-25-21-12-13-22(24-11-6-16-36-24)32-28(21)37-26(25)29(35)33-15-14-18-7-4-5-10-20(18)23(33)17-31-27(34)19-8-2-1-3-9-19/h4-7,10-13,16,19,23H,1-3,8-9,14-15,17,30H2,(H,31,34)