N-(1,3-benzothiazol-2-yl)-4-(3,4-dihydro-1H-isoquinolin-2-ylsulfonyl)-N-(pyridin-2-ylmethyl)benzamide

Systemtic Name: N-(1,3-benzothiazol-2-yl)-4-(3,4-dihydro-1H-isoquinolin-2-ylsulfonyl)-N-(pyridin-2-ylmethyl)benzamide Openeye Name: N-(1,3-benzothiazol-2-yl)-4-(3,4-dihydro-1H-isoquinolin-2-ylsulfonyl)-N-(2-pyridylmethyl)benzamide CAS Name: N-(1,3-benzothiazol-2-yl)-4-(3,4-dihydro-1H-isoquinolin-2-ylsulfonyl)-N-(2-pyridinylmethyl)benzamide IUPAC Name: N-(1,3-benzothiazol-2-yl)-4-(3,4-dihydro-1H-isoquinolin-2-ylsulfonyl)-N-(pyridin-2-ylmethyl)benzamide Traditional Name: N-(1,3-benzothiazol-2-yl)-4-(3,4-dihydro-1H-isoquinolin-2-ylsulfonyl)-N-(2-pyridylmethyl)benzamide Formula: C29H24N4O3S2 MolecularWeight: 540.65586

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC2=CC=CC=C21)S(=O)(=O)C3=CC=C(C=C3)C(=O)N(CC4=CC=CC=N4)C5=NC6=CC=CC=C6S5

Isomeric SMILES

C1CN(CC2=CC=CC=C21)S(=O)(=O)C3=CC=C(C=C3)C(=O)N(CC4=CC=CC=N4)C5=NC6=CC=CC=C6S5

InChI

InChI=1S/C29H24N4O3S2/c34-28(33(20-24-9-5-6-17-30-24)29-31-26-10-3-4-11-27(26)37-29)22-12-14-25(15-13-22)38(35,36)32-18-16-21-7-1-2-8-23(21)19-32/h1-15,17H,16,18-20H2