N-[6-azanylidene-1-(1-naphthalen-1-ylethylamino)-1-oxidanylidene-4-(pyridin-2-ylmethylamino)-6-(sulfinylamino)hexan-2-yl]-N-methyl-benzamide

Systemtic Name: N-[6-azanylidene-1-(1-naphthalen-1-ylethylamino)-1-oxidanylidene-4-(pyridin-2-ylmethylamino)-6-(sulfinylamino)hexan-2-yl]-N-methyl-benzamide Openeye Name: N-[5-imino-1-[1-(1-naphthyl)ethylcarbamoyl]-3-(2-pyridylmethylamino)-5-(sulfinylamino)pentyl]-N-methyl-benzamide CAS Name: N-[6-imino-1-[1-(1-naphthalenyl)ethylamino]-1-oxo-4-(2-pyridinylmethylamino)-6-(sulfinylamino)hexan-2-yl]-N-methylbenzamide IUPAC Name: N-[6-imino-1-(1-naphthalen-1-ylethylamino)-1-oxo-4-(pyridin-2-ylmethylamino)-6-(sulfinylamino)hexan-2-yl]-N-methylbenzamide Traditional Name: N-[5-imino-1-[1-(1-naphthyl)ethylcarbamoyl]-3-(2-pyridylmethylamino)-5-(sulfinylamino)pentyl]-N-methyl-benzamide Formula: C32H34N6O3S MolecularWeight: 582.71576

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC=CC2=CC=CC=C21)NC(=O)C(CC(CC(=N)N=S=O)NCC3=CC=CC=N3)N(C)C(=O)C4=CC=CC=C4

Isomeric SMILES

CC(C1=CC=CC2=CC=CC=C21)NC(=O)C(CC(CC(=N)N=S=O)NCC3=CC=CC=N3)N(C)C(=O)C4=CC=CC=C4

InChI

InChI=1S/C32H34N6O3S/c1-22(27-17-10-14-23-11-6-7-16-28(23)27)36-31(39)29(38(2)32(40)24-12-4-3-5-13-24)19-26(20-30(33)37-42-41)35-21-25-15-8-9-18-34-25/h3-18,22,26,29,33,35H,19-21H2,1-2H3,(H,36,39)