N-[(E)-(3-nitrophenyl)methylideneamino]-4-(4-pyrrolidin-1-ylsulfonylphenyl)-1,3-thiazol-2-amine

Systemtic Name: N-[(E)-(3-nitrophenyl)methylideneamino]-4-(4-pyrrolidin-1-ylsulfonylphenyl)-1,3-thiazol-2-amine Openeye Name: N-[(E)-(3-nitrophenyl)methyleneamino]-4-(4-pyrrolidin-1-ylsulfonylphenyl)thiazol-2-amine CAS Name: N-[(E)-(3-nitrophenyl)methylideneamino]-4-[4-(1-pyrrolidinylsulfonyl)phenyl]-2-thiazolamine IUPAC Name: N-[(E)-(3-nitrophenyl)methylideneamino]-4-(4-pyrrolidin-1-ylsulfonylphenyl)-1,3-thiazol-2-amine Traditional Name: [(E)-(3-nitrobenzylidene)amino]-[4-(4-pyrrolidinosulfonylphenyl)thiazol-2-yl]amine Formula: C20H19N5O4S2 MolecularWeight: 457.52596

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)S(=O)(=O)C2=CC=C(C=C2)C3=CSC(=N3)NN=CC4=CC(=CC=C4)[N+](=O)[O-]

Isomeric SMILES

C1CCN(C1)S(=O)(=O)C2=CC=C(C=C2)C3=CSC(=N3)N/N=C/C4=CC(=CC=C4)[N+](=O)[O-]

InChI

InChI=1S/C20H19N5O4S2/c26-25(27)17-5-3-4-15(12-17)13-21-23-20-22-19(14-30-20)16-6-8-18(9-7-16)31(28,29)24-10-1-2-11-24/h3-9,12-14H,1-2,10-11H2,(H,22,23)/b21-13+