1-(4-methoxyphenyl)-N-[1-(4-methylpiperazin-1-yl)-4-methylsulfanyl-1-oxidanylidene-butan-2-yl]-5-oxidanylidene-pyrrolidine-3-carboxamide

Systemtic Name: 1-(4-methoxyphenyl)-N-[1-(4-methylpiperazin-1-yl)-4-methylsulfanyl-1-oxidanylidene-butan-2-yl]-5-oxidanylidene-pyrrolidine-3-carboxamide Openeye Name: 1-(4-methoxyphenyl)-N-[1-(4-methylpiperazine-1-carbonyl)-3-methylsulfanyl-propyl]-5-oxo-pyrrolidine-3-carboxamide CAS Name: 1-(4-methoxyphenyl)-N-[1-(4-methyl-1-piperazinyl)-4-(methylthio)-1-oxobutan-2-yl]-5-oxo-3-pyrrolidinecarboxamide IUPAC Name: 1-(4-methoxyphenyl)-N-[1-(4-methylpiperazin-1-yl)-4-methylsulfanyl-1-oxobutan-2-yl]-5-oxopyrrolidine-3-carboxamide Traditional Name: 5-keto-1-(4-methoxyphenyl)-N-[1-(4-methylpiperazine-1-carbonyl)-3-(methylthio)propyl]pyrrolidine-3-carboxamide Formula: C22H32N4O4S MolecularWeight: 448.57888

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCN(CC1)C(=O)C(CCSC)NC(=O)C2CC(=O)N(C2)C3=CC=C(C=C3)OC

Isomeric SMILES

CN1CCN(CC1)C(=O)C(CCSC)NC(=O)C2CC(=O)N(C2)C3=CC=C(C=C3)OC

InChI

InChI=1S/C22H32N4O4S/c1-24-9-11-25(12-10-24)22(29)19(8-13-31-3)23-21(28)16-14-20(27)26(15-16)17-4-6-18(30-2)7-5-17/h4-7,16,19H,8-15H2,1-3H3,(H,23,28)