2-[5-(4-ethylpiperidin-1-yl)-5-oxidanylidene-4-(9H-xanthen-2-ylsulfonylamino)pentyl]guanidine

Systemtic Name: 2-[5-(4-ethylpiperidin-1-yl)-5-oxidanylidene-4-(9H-xanthen-2-ylsulfonylamino)pentyl]guanidine Openeye Name: 2-[5-(4-ethyl-1-piperidyl)-5-oxo-4-(9H-xanthen-2-ylsulfonylamino)pentyl]guanidine CAS Name: 2-[5-(4-ethyl-1-piperidinyl)-5-oxo-4-(9H-xanthen-2-ylsulfonylamino)pentyl]guanidine IUPAC Name: 2-[5-(4-ethylpiperidin-1-yl)-5-oxo-4-(9H-xanthen-2-ylsulfonylamino)pentyl]guanidine Traditional Name: 2-[5-(4-ethylpiperidino)-5-keto-4-(9H-xanthen-2-ylsulfonylamino)pentyl]guanidine Formula: C26H35N5O4S MolecularWeight: 513.6522

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Descriptors Computed from Structure

Canonical SMILES:

CCC1CCN(CC1)C(=O)C(CCCN=C(N)N)NS(=O)(=O)C2=CC3=C(C=C2)OC4=CC=CC=C4C3

Isomeric SMILES

CCC1CCN(CC1)C(=O)C(CCCN=C(N)N)NS(=O)(=O)C2=CC3=C(C=C2)OC4=CC=CC=C4C3

InChI

InChI=1S/C26H35N5O4S/c1-2-18-11-14-31(15-12-18)25(32)22(7-5-13-29-26(27)28)30-36(33,34)21-9-10-24-20(17-21)16-19-6-3-4-8-23(19)35-24/h3-4,6,8-10,17-18,22,30H,2,5,7,11-16H2,1H3,(H4,27,28,29)