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

Systemtic Name: N-(1,3-benzothiazol-2-yl)-4-chloranyl-3-(3,4-dihydro-1H-isoquinolin-2-ylsulfonyl)-N-(2-methylpropyl)benzamide Openeye Name: N-(1,3-benzothiazol-2-yl)-4-chloro-3-(3,4-dihydro-1H-isoquinolin-2-ylsulfonyl)-N-isobutyl-benzamide CAS Name: N-(1,3-benzothiazol-2-yl)-4-chloro-3-(3,4-dihydro-1H-isoquinolin-2-ylsulfonyl)-N-(2-methylpropyl)benzamide IUPAC Name: N-(1,3-benzothiazol-2-yl)-4-chloro-3-(3,4-dihydro-1H-isoquinolin-2-ylsulfonyl)-N-(2-methylpropyl)benzamide Traditional Name: N-(1,3-benzothiazol-2-yl)-4-chloro-3-(3,4-dihydro-1H-isoquinolin-2-ylsulfonyl)-N-isobutyl-benzamide Formula: C27H26ClN3O3S2 MolecularWeight: 540.09664

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CN(C1=NC2=CC=CC=C2S1)C(=O)C3=CC(=C(C=C3)Cl)S(=O)(=O)N4CCC5=CC=CC=C5C4

Isomeric SMILES

CC(C)CN(C1=NC2=CC=CC=C2S1)C(=O)C3=CC(=C(C=C3)Cl)S(=O)(=O)N4CCC5=CC=CC=C5C4

InChI

InChI=1S/C27H26ClN3O3S2/c1-18(2)16-31(27-29-23-9-5-6-10-24(23)35-27)26(32)20-11-12-22(28)25(15-20)36(33,34)30-14-13-19-7-3-4-8-21(19)17-30/h3-12,15,18H,13-14,16-17H2,1-2H3