2-chloranyl-N-[1-[[2-(3-methoxyphenyl)-2-pyrrolidin-1-yl-ethyl]amino]-4-methylsulfanyl-1-oxidanylidene-butan-2-yl]benzamide

Systemtic Name: 2-chloranyl-N-[1-[[2-(3-methoxyphenyl)-2-pyrrolidin-1-yl-ethyl]amino]-4-methylsulfanyl-1-oxidanylidene-butan-2-yl]benzamide Openeye Name: 2-chloro-N-[1-[[2-(3-methoxyphenyl)-2-pyrrolidin-1-yl-ethyl]carbamoyl]-3-methylsulfanyl-propyl]benzamide CAS Name: 2-chloro-N-[1-[[2-(3-methoxyphenyl)-2-(1-pyrrolidinyl)ethyl]amino]-4-(methylthio)-1-oxobutan-2-yl]benzamide IUPAC Name: 2-chloro-N-[1-[[2-(3-methoxyphenyl)-2-pyrrolidin-1-ylethyl]amino]-4-methylsulfanyl-1-oxobutan-2-yl]benzamide Traditional Name: 2-chloro-N-[1-[[2-(3-methoxyphenyl)-2-pyrrolidino-ethyl]carbamoyl]-3-(methylthio)propyl]benzamide Formula: C25H32ClN3O3S MolecularWeight: 490.05788

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1)C(CNC(=O)C(CCSC)NC(=O)C2=CC=CC=C2Cl)N3CCCC3

Isomeric SMILES

COC1=CC=CC(=C1)C(CNC(=O)C(CCSC)NC(=O)C2=CC=CC=C2Cl)N3CCCC3

InChI

InChI=1S/C25H32ClN3O3S/c1-32-19-9-7-8-18(16-19)23(29-13-5-6-14-29)17-27-25(31)22(12-15-33-2)28-24(30)20-10-3-4-11-21(20)26/h3-4,7-11,16,22-23H,5-6,12-15,17H2,1-2H3,(H,27,31)(H,28,30)