1-(N'-decylcarbamimidoyl)-2-(4-propoxyphenyl)sulfonyl-guanidine

Systemtic Name: 1-(N'-decylcarbamimidoyl)-2-(4-propoxyphenyl)sulfonyl-guanidine Openeye Name: 1-(N'-decylcarbamimidoyl)-2-(4-propoxyphenyl)sulfonyl-guanidine CAS Name: 1-[amino(decylimino)methyl]-2-(4-propoxyphenyl)sulfonylguanidine IUPAC Name: 1-(N'-decylcarbamimidoyl)-2-(4-propoxyphenyl)sulfonylguanidine Traditional Name: 1-(N'-decylamidino)-2-(4-propoxyphenyl)sulfonyl-guanidine Formula: C21H37N5O3S MolecularWeight: 439.61518

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCN=C(N)NC(=NS(=O)(=O)C1=CC=C(C=C1)OCCC)N

Isomeric SMILES

CCCCCCCCCCN=C(N)NC(=NS(=O)(=O)C1=CC=C(C=C1)OCCC)N

InChI

InChI=1S/C21H37N5O3S/c1-3-5-6-7-8-9-10-11-16-24-20(22)25-21(23)26-30(27,28)19-14-12-18(13-15-19)29-17-4-2/h12-15H,3-11,16-17H2,1-2H3,(H5,22,23,24,25,26)