N-cyclopropyl-2-nitro-5-[4-(4-phenyl-1,3-thiazol-2-yl)piperazin-1-yl]aniline

Systemtic Name: N-cyclopropyl-2-nitro-5-[4-(4-phenyl-1,3-thiazol-2-yl)piperazin-1-yl]aniline Openeye Name: N-cyclopropyl-2-nitro-5-[4-(4-phenylthiazol-2-yl)piperazin-1-yl]aniline CAS Name: N-cyclopropyl-2-nitro-5-[4-(4-phenyl-2-thiazolyl)-1-piperazinyl]aniline IUPAC Name: N-cyclopropyl-2-nitro-5-[4-(4-phenyl-1,3-thiazol-2-yl)piperazin-1-yl]aniline Traditional Name: cyclopropyl-[2-nitro-5-[4-(4-phenylthiazol-2-yl)piperazino]phenyl]amine Formula: C22H23N5O2S MolecularWeight: 421.51532

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Descriptors Computed from Structure

Canonical SMILES:

C1CC1NC2=C(C=CC(=C2)N3CCN(CC3)C4=NC(=CS4)C5=CC=CC=C5)[N+](=O)[O-]

Isomeric SMILES

C1CC1NC2=C(C=CC(=C2)N3CCN(CC3)C4=NC(=CS4)C5=CC=CC=C5)[N+](=O)[O-]

InChI

InChI=1S/C22H23N5O2S/c28-27(29)21-9-8-18(14-19(21)23-17-6-7-17)25-10-12-26(13-11-25)22-24-20(15-30-22)16-4-2-1-3-5-16/h1-5,8-9,14-15,17,23H,6-7,10-13H2