2-chloranyl-N-[1-[[4-(4-ethylpiperazin-1-yl)-3-methyl-phenyl]amino]-4-methylsulfanyl-1-oxidanylidene-butan-2-yl]benzamide

Systemtic Name: 2-chloranyl-N-[1-[[4-(4-ethylpiperazin-1-yl)-3-methyl-phenyl]amino]-4-methylsulfanyl-1-oxidanylidene-butan-2-yl]benzamide Openeye Name: 2-chloro-N-[1-[[4-(4-ethylpiperazin-1-yl)-3-methyl-phenyl]carbamoyl]-3-methylsulfanyl-propyl]benzamide CAS Name: 2-chloro-N-[1-[4-(4-ethyl-1-piperazinyl)-3-methylanilino]-4-(methylthio)-1-oxobutan-2-yl]benzamide IUPAC Name: 2-chloro-N-[1-[4-(4-ethylpiperazin-1-yl)-3-methylanilino]-4-methylsulfanyl-1-oxobutan-2-yl]benzamide Traditional Name: 2-chloro-N-[1-[[4-(4-ethylpiperazino)-3-methyl-phenyl]carbamoyl]-3-(methylthio)propyl]benzamide Formula: C25H33ClN4O2S MolecularWeight: 489.07312

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Descriptors Computed from Structure

Canonical SMILES:

CCN1CCN(CC1)C2=C(C=C(C=C2)NC(=O)C(CCSC)NC(=O)C3=CC=CC=C3Cl)C

Isomeric SMILES

CCN1CCN(CC1)C2=C(C=C(C=C2)NC(=O)C(CCSC)NC(=O)C3=CC=CC=C3Cl)C

InChI

InChI=1S/C25H33ClN4O2S/c1-4-29-12-14-30(15-13-29)23-10-9-19(17-18(23)2)27-25(32)22(11-16-33-3)28-24(31)20-7-5-6-8-21(20)26/h5-10,17,22H,4,11-16H2,1-3H3,(H,27,32)(H,28,31)