4-(dimethylamino)-N-[5-[3-(4-ethanoylpiperazin-1-yl)carbonyl-4-nitro-phenyl]sulfanyl-1,3-thiazol-2-yl]benzamide

Systemtic Name: 4-(dimethylamino)-N-[5-[3-(4-ethanoylpiperazin-1-yl)carbonyl-4-nitro-phenyl]sulfanyl-1,3-thiazol-2-yl]benzamide Openeye Name: N-[5-[3-(4-acetylpiperazine-1-carbonyl)-4-nitro-phenyl]sulfanylthiazol-2-yl]-4-(dimethylamino)benzamide CAS Name: N-[5-[[3-[(4-acetyl-1-piperazinyl)-oxomethyl]-4-nitrophenyl]thio]-2-thiazolyl]-4-(dimethylamino)benzamide IUPAC Name: N-[5-[3-(4-acetylpiperazine-1-carbonyl)-4-nitrophenyl]sulfanyl-1,3-thiazol-2-yl]-4-(dimethylamino)benzamide Traditional Name: N-[5-[[3-(4-acetylpiperazine-1-carbonyl)-4-nitro-phenyl]thio]thiazol-2-yl]-4-(dimethylamino)benzamide Formula: C25H26N6O5S2 MolecularWeight: 554.64114

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)N1CCN(CC1)C(=O)C2=C(C=CC(=C2)SC3=CN=C(S3)NC(=O)C4=CC=C(C=C4)N(C)C)[N+](=O)[O-]

Isomeric SMILES

CC(=O)N1CCN(CC1)C(=O)C2=C(C=CC(=C2)SC3=CN=C(S3)NC(=O)C4=CC=C(C=C4)N(C)C)[N+](=O)[O-]

InChI

InChI=1S/C25H26N6O5S2/c1-16(32)29-10-12-30(13-11-29)24(34)20-14-19(8-9-21(20)31(35)36)37-22-15-26-25(38-22)27-23(33)17-4-6-18(7-5-17)28(2)3/h4-9,14-15H,10-13H2,1-3H3,(H,26,27,33)