4-[2-[5-[2-diethylaminoethyl-(6-oxidanylnaphthalen-2-yl)sulfonyl-amino]-1-methyl-benzimidazol-2-yl]ethyl]-N'-oxidanyl-benzenecarboximidamide

Systemtic Name: 4-[2-[5-[2-diethylaminoethyl-(6-oxidanylnaphthalen-2-yl)sulfonyl-amino]-1-methyl-benzimidazol-2-yl]ethyl]-N'-oxidanyl-benzenecarboximidamide Openeye Name: 4-[2-[5-[2-diethylaminoethyl-[(6-hydroxy-2-naphthyl)sulfonyl]amino]-1-methyl-benzimidazol-2-yl]ethyl]-N'-hydroxy-benzamidine CAS Name: 4-[2-[5-[2-diethylaminoethyl-[(6-hydroxy-2-naphthalenyl)sulfonyl]amino]-1-methyl-2-benzimidazolyl]ethyl]-N'-hydroxybenzenecarboximidamide IUPAC Name: 4-[2-[5-[2-diethylaminoethyl-(6-hydroxynaphthalen-2-yl)sulfonylamino]-1-methylbenzimidazol-2-yl]ethyl]-N'-hydroxybenzenecarboximidamide Traditional Name: 4-[2-[5-[2-diethylaminoethyl-[(6-hydroxy-2-naphthyl)sulfonyl]amino]-1-methyl-benzimidazol-2-yl]ethyl]-N'-hydroxy-benzamidine Formula: C33H38N6O4S MolecularWeight: 614.75762

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)CCN(C1=CC2=C(C=C1)N(C(=N2)CCC3=CC=C(C=C3)C(=NO)N)C)S(=O)(=O)C4=CC5=C(C=C4)C=C(C=C5)O

Isomeric SMILES

CCN(CC)CCN(C1=CC2=C(C=C1)N(C(=N2)CCC3=CC=C(C=C3)/C(=N/O)/N)C)S(=O)(=O)C4=CC5=C(C=C4)C=C(C=C5)O

InChI

InChI=1S/C33H38N6O4S/c1-4-38(5-2)18-19-39(44(42,43)29-15-12-25-20-28(40)14-11-26(25)21-29)27-13-16-31-30(22-27)35-32(37(31)3)17-8-23-6-9-24(10-7-23)33(34)36-41/h6-7,9-16,20-22,40-41H,4-5,8,17-19H2,1-3H3,(H2,34,36)