(2-butyl-4-methyl-1,3-thiazol-5-yl)-[4-(4-chloranyl-2-nitro-phenyl)piperazin-1-yl]methanone

Systemtic Name: (2-butyl-4-methyl-1,3-thiazol-5-yl)-[4-(4-chloranyl-2-nitro-phenyl)piperazin-1-yl]methanone Openeye Name: (2-butyl-4-methyl-thiazol-5-yl)-[4-(4-chloro-2-nitro-phenyl)piperazin-1-yl]methanone CAS Name: (2-butyl-4-methyl-5-thiazolyl)-[4-(4-chloro-2-nitrophenyl)-1-piperazinyl]methanone IUPAC Name: (2-butyl-4-methyl-1,3-thiazol-5-yl)-[4-(4-chloro-2-nitrophenyl)piperazin-1-yl]methanone Traditional Name: (2-butyl-4-methyl-thiazol-5-yl)-[4-(4-chloro-2-nitro-phenyl)piperazino]methanone Formula: C19H23ClN4O3S MolecularWeight: 422.92892

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=NC(=C(S1)C(=O)N2CCN(CC2)C3=C(C=C(C=C3)Cl)[N+](=O)[O-])C

Isomeric SMILES

CCCCC1=NC(=C(S1)C(=O)N2CCN(CC2)C3=C(C=C(C=C3)Cl)[N+](=O)[O-])C

InChI

InChI=1S/C19H23ClN4O3S/c1-3-4-5-17-21-13(2)18(28-17)19(25)23-10-8-22(9-11-23)15-7-6-14(20)12-16(15)24(26)27/h6-7,12H,3-5,8-11H2,1-2H3