N-[(E)-1-(5-bromanylthiophen-2-yl)ethylideneamino]-2-nitro-4-pyrrolidin-1-ylsulfonyl-aniline

Systemtic Name: N-[(E)-1-(5-bromanylthiophen-2-yl)ethylideneamino]-2-nitro-4-pyrrolidin-1-ylsulfonyl-aniline Openeye Name: N-[(E)-1-(5-bromo-2-thienyl)ethylideneamino]-2-nitro-4-pyrrolidin-1-ylsulfonyl-aniline CAS Name: N-[(E)-1-(5-bromo-2-thiophenyl)ethylideneamino]-2-nitro-4-(1-pyrrolidinylsulfonyl)aniline IUPAC Name: N-[(E)-1-(5-bromothiophen-2-yl)ethylideneamino]-2-nitro-4-pyrrolidin-1-ylsulfonylaniline Traditional Name: [(E)-1-(5-bromo-2-thienyl)ethylideneamino]-(2-nitro-4-pyrrolidinosulfonyl-phenyl)amine Formula: C16H17BrN4O4S2 MolecularWeight: 473.36458

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Descriptors Computed from Structure

Canonical SMILES:

CC(=NNC1=C(C=C(C=C1)S(=O)(=O)N2CCCC2)[N+](=O)[O-])C3=CC=C(S3)Br

Isomeric SMILES

C/C(=N\NC1=C(C=C(C=C1)S(=O)(=O)N2CCCC2)[N+](=O)[O-])/C3=CC=C(S3)Br

InChI

InChI=1S/C16H17BrN4O4S2/c1-11(15-6-7-16(17)26-15)18-19-13-5-4-12(10-14(13)21(22)23)27(24,25)20-8-2-3-9-20/h4-7,10,19H,2-3,8-9H2,1H3/b18-11+