4-[2-[5-[(4-tert-butylphenyl)sulfonyl-(2-diethylaminoethyl)amino]-1-methyl-benzimidazol-2-yl]ethyl]benzenecarboximidamide

Systemtic Name: 4-[2-[5-[(4-tert-butylphenyl)sulfonyl-(2-diethylaminoethyl)amino]-1-methyl-benzimidazol-2-yl]ethyl]benzenecarboximidamide Openeye Name: 4-[2-[5-[(4-tert-butylphenyl)sulfonyl-(2-diethylaminoethyl)amino]-1-methyl-benzimidazol-2-yl]ethyl]benzamidine CAS Name: 4-[2-[5-[(4-tert-butylphenyl)sulfonyl-(2-diethylaminoethyl)amino]-1-methyl-2-benzimidazolyl]ethyl]benzenecarboximidamide IUPAC Name: 4-[2-[5-[(4-tert-butylphenyl)sulfonyl-(2-diethylaminoethyl)amino]-1-methylbenzimidazol-2-yl]ethyl]benzenecarboximidamide Traditional Name: 4-[2-[5-[(4-tert-butylphenyl)sulfonyl-(2-diethylaminoethyl)amino]-1-methyl-benzimidazol-2-yl]ethyl]benzamidine Formula: C33H44N6O2S MolecularWeight: 588.80646

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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(=N)N)C)S(=O)(=O)C4=CC=C(C=C4)C(C)(C)C

Isomeric SMILES

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

InChI

InChI=1S/C33H44N6O2S/c1-7-38(8-2)21-22-39(42(40,41)28-17-14-26(15-18-28)33(3,4)5)27-16-19-30-29(23-27)36-31(37(30)6)20-11-24-9-12-25(13-10-24)32(34)35/h9-10,12-19,23H,7-8,11,20-22H2,1-6H3,(H3,34,35)