1-(cyclopropylmethyl)-2-[(4-ethoxyphenyl)methyl]-5-(4-methylpiperazin-1-yl)sulfonyl-benzimidazole

Systemtic Name: 1-(cyclopropylmethyl)-2-[(4-ethoxyphenyl)methyl]-5-(4-methylpiperazin-1-yl)sulfonyl-benzimidazole Openeye Name: 1-(cyclopropylmethyl)-2-[(4-ethoxyphenyl)methyl]-5-(4-methylpiperazin-1-yl)sulfonyl-benzimidazole CAS Name: 1-(cyclopropylmethyl)-2-[(4-ethoxyphenyl)methyl]-5-[(4-methyl-1-piperazinyl)sulfonyl]benzimidazole IUPAC Name: 1-(cyclopropylmethyl)-2-[(4-ethoxyphenyl)methyl]-5-(4-methylpiperazin-1-yl)sulfonylbenzimidazole Traditional Name: 1-(cyclopropylmethyl)-2-(4-ethoxybenzyl)-5-(4-methylpiperazino)sulfonyl-benzimidazole Formula: C25H32N4O3S MolecularWeight: 468.61158

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)CC2=NC3=C(N2CC4CC4)C=CC(=C3)S(=O)(=O)N5CCN(CC5)C

Isomeric SMILES

CCOC1=CC=C(C=C1)CC2=NC3=C(N2CC4CC4)C=CC(=C3)S(=O)(=O)N5CCN(CC5)C

InChI

InChI=1S/C25H32N4O3S/c1-3-32-21-8-6-19(7-9-21)16-25-26-23-17-22(10-11-24(23)29(25)18-20-4-5-20)33(30,31)28-14-12-27(2)13-15-28/h6-11,17,20H,3-5,12-16,18H2,1-2H3