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

Systemtic Name: N-[5-[4-acetamido-3-(4-ethanoylpiperazin-1-yl)carbonyl-phenyl]sulfanyl-1,3-thiazol-2-yl]-4-(dimethylamino)benzamide Openeye Name: N-[5-[4-acetamido-3-(4-acetylpiperazine-1-carbonyl)phenyl]sulfanylthiazol-2-yl]-4-(dimethylamino)benzamide CAS Name: N-[5-[[4-acetamido-3-[(4-acetyl-1-piperazinyl)-oxomethyl]phenyl]thio]-2-thiazolyl]-4-(dimethylamino)benzamide IUPAC Name: N-[5-[4-acetamido-3-(4-acetylpiperazine-1-carbonyl)phenyl]sulfanyl-1,3-thiazol-2-yl]-4-(dimethylamino)benzamide Traditional Name: N-[5-[[4-acetamido-3-(4-acetylpiperazine-1-carbonyl)phenyl]thio]thiazol-2-yl]-4-(dimethylamino)benzamide Formula: C27H30N6O4S2 MolecularWeight: 566.6949

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=C(C=C(C=C1)SC2=CN=C(S2)NC(=O)C3=CC=C(C=C3)N(C)C)C(=O)N4CCN(CC4)C(=O)C

Isomeric SMILES

CC(=O)NC1=C(C=C(C=C1)SC2=CN=C(S2)NC(=O)C3=CC=C(C=C3)N(C)C)C(=O)N4CCN(CC4)C(=O)C

InChI

InChI=1S/C27H30N6O4S2/c1-17(34)29-23-10-9-21(15-22(23)26(37)33-13-11-32(12-14-33)18(2)35)38-24-16-28-27(39-24)30-25(36)19-5-7-20(8-6-19)31(3)4/h5-10,15-16H,11-14H2,1-4H3,(H,29,34)(H,28,30,36)