[2-(methoxycarbonylamino)-3H-benzimidazol-5-yl] 4-(ethylamino)benzenesulfonate

Systemtic Name: [2-(methoxycarbonylamino)-3H-benzimidazol-5-yl] 4-(ethylamino)benzenesulfonate Openeye Name: [2-(methoxycarbonylamino)-3H-benzimidazol-5-yl] 4-(ethylamino)benzenesulfonate CAS Name: 4-(ethylamino)benzenesulfonic acid [2-(methoxycarbonylamino)-3H-benzimidazol-5-yl] ester IUPAC Name: [2-(methoxycarbonylamino)-3H-benzimidazol-5-yl] 4-(ethylamino)benzenesulfonate Traditional Name: 4-(ethylamino)benzenesulfonic acid [2-(carbomethoxyamino)-3H-benzimidazol-5-yl] ester Formula: C17H18N4O5S MolecularWeight: 390.41362

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Descriptors Computed from Structure

Canonical SMILES:

CCNC1=CC=C(C=C1)S(=O)(=O)OC2=CC3=C(C=C2)N=C(N3)NC(=O)OC

Isomeric SMILES

CCNC1=CC=C(C=C1)S(=O)(=O)OC2=CC3=C(C=C2)N=C(N3)NC(=O)OC

InChI

InChI=1S/C17H18N4O5S/c1-3-18-11-4-7-13(8-5-11)27(23,24)26-12-6-9-14-15(10-12)20-16(19-14)21-17(22)25-2/h4-10,18H,3H2,1-2H3,(H2,19,20,21,22)