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

Systemtic Name: N-[4-[(6-methoxy-3,4-dihydro-1H-isoquinolin-2-yl)methyl]-1,3-thiazol-2-yl]-4-morpholin-4-ylsulfonyl-benzamide Openeye Name: N-[4-[(6-methoxy-3,4-dihydro-1H-isoquinolin-2-yl)methyl]thiazol-2-yl]-4-morpholinosulfonyl-benzamide CAS Name: N-[4-[(6-methoxy-3,4-dihydro-1H-isoquinolin-2-yl)methyl]-2-thiazolyl]-4-(4-morpholinylsulfonyl)benzamide IUPAC Name: N-[4-[(6-methoxy-3,4-dihydro-1H-isoquinolin-2-yl)methyl]-1,3-thiazol-2-yl]-4-morpholin-4-ylsulfonylbenzamide Traditional Name: N-[4-[(6-methoxy-3,4-dihydro-1H-isoquinolin-2-yl)methyl]thiazol-2-yl]-4-morpholinosulfonyl-benzamide Formula: C25H28N4O5S2 MolecularWeight: 528.64362

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC2=C(CN(CC2)CC3=CSC(=N3)NC(=O)C4=CC=C(C=C4)S(=O)(=O)N5CCOCC5)C=C1

Isomeric SMILES

COC1=CC2=C(CN(CC2)CC3=CSC(=N3)NC(=O)C4=CC=C(C=C4)S(=O)(=O)N5CCOCC5)C=C1

InChI

InChI=1S/C25H28N4O5S2/c1-33-22-5-2-20-15-28(9-8-19(20)14-22)16-21-17-35-25(26-21)27-24(30)18-3-6-23(7-4-18)36(31,32)29-10-12-34-13-11-29/h2-7,14,17H,8-13,15-16H2,1H3,(H,26,27,30)