N-[4-[(6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl)methyl]-1,3-thiazol-2-yl]-4-piperidin-1-ylsulfonyl-benzamide

Systemtic Name: N-[4-[(6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl)methyl]-1,3-thiazol-2-yl]-4-piperidin-1-ylsulfonyl-benzamide Openeye Name: N-[4-[(6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl)methyl]thiazol-2-yl]-4-(1-piperidylsulfonyl)benzamide CAS Name: N-[4-[(6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl)methyl]-2-thiazolyl]-4-(1-piperidinylsulfonyl)benzamide IUPAC Name: N-[4-[(6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl)methyl]-1,3-thiazol-2-yl]-4-piperidin-1-ylsulfonylbenzamide Traditional Name: N-[4-[(6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl)methyl]thiazol-2-yl]-4-piperidinosulfonyl-benzamide Formula: C27H32N4O5S2 MolecularWeight: 556.69678

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C2CN(CCC2=C1)CC3=CSC(=N3)NC(=O)C4=CC=C(C=C4)S(=O)(=O)N5CCCCC5)OC

Isomeric SMILES

COC1=C(C=C2CN(CCC2=C1)CC3=CSC(=N3)NC(=O)C4=CC=C(C=C4)S(=O)(=O)N5CCCCC5)OC

InChI

InChI=1S/C27H32N4O5S2/c1-35-24-14-20-10-13-30(16-21(20)15-25(24)36-2)17-22-18-37-27(28-22)29-26(32)19-6-8-23(9-7-19)38(33,34)31-11-4-3-5-12-31/h6-9,14-15,18H,3-5,10-13,16-17H2,1-2H3,(H,28,29,32)