2-[(E)-1-[1-(2-methyl-5-nitro-phenyl)sulfonylindol-3-yl]ethylideneamino]guanidine

Systemtic Name: 2-[(E)-1-[1-(2-methyl-5-nitro-phenyl)sulfonylindol-3-yl]ethylideneamino]guanidine Openeye Name: 2-[(E)-1-[1-(2-methyl-5-nitro-phenyl)sulfonylindol-3-yl]ethylideneamino]guanidine CAS Name: 2-[(E)-1-[1-(2-methyl-5-nitrophenyl)sulfonyl-3-indolyl]ethylideneamino]guanidine IUPAC Name: 2-[(E)-1-[1-(2-methyl-5-nitrophenyl)sulfonylindol-3-yl]ethylideneamino]guanidine Traditional Name: 2-[(E)-1-[1-(2-methyl-5-nitro-phenyl)sulfonylindol-3-yl]ethylideneamino]guanidine Formula: C18H18N6O4S MolecularWeight: 414.43832

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)[N+](=O)[O-])S(=O)(=O)N2C=C(C3=CC=CC=C32)C(=NN=C(N)N)C

Isomeric SMILES

CC1=C(C=C(C=C1)[N+](=O)[O-])S(=O)(=O)N2C=C(C3=CC=CC=C32)/C(=N/N=C(N)N)/C

InChI

InChI=1S/C18H18N6O4S/c1-11-7-8-13(24(25)26)9-17(11)29(27,28)23-10-15(12(2)21-22-18(19)20)14-5-3-4-6-16(14)23/h3-10H,1-2H3,(H4,19,20,22)/b21-12+