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

Systemtic Name: [4-[(2-methyl-1,3-thiazol-4-yl)methyl]piperazin-1-yl]-(3-nitro-4-phenylazanyl-phenyl)methanone Openeye Name: (4-anilino-3-nitro-phenyl)-[4-[(2-methylthiazol-4-yl)methyl]piperazin-1-yl]methanone CAS Name: (4-anilino-3-nitrophenyl)-[4-[(2-methyl-4-thiazolyl)methyl]-1-piperazinyl]methanone IUPAC Name: (4-anilino-3-nitrophenyl)-[4-[(2-methyl-1,3-thiazol-4-yl)methyl]piperazin-1-yl]methanone Traditional Name: (4-anilino-3-nitro-phenyl)-[4-[(2-methylthiazol-4-yl)methyl]piperazino]methanone Formula: C22H23N5O3S MolecularWeight: 437.51472

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC(=CS1)CN2CCN(CC2)C(=O)C3=CC(=C(C=C3)NC4=CC=CC=C4)[N+](=O)[O-]

Isomeric SMILES

CC1=NC(=CS1)CN2CCN(CC2)C(=O)C3=CC(=C(C=C3)NC4=CC=CC=C4)[N+](=O)[O-]

InChI

InChI=1S/C22H23N5O3S/c1-16-23-19(15-31-16)14-25-9-11-26(12-10-25)22(28)17-7-8-20(21(13-17)27(29)30)24-18-5-3-2-4-6-18/h2-8,13,15,24H,9-12,14H2,1H3