2-methoxy-N-[1-[[4-[(3-methylpiperidin-1-yl)methyl]phenyl]methylamino]-4-methylsulfanyl-1-oxidanylidene-butan-2-yl]benzamide

Systemtic Name: 2-methoxy-N-[1-[[4-[(3-methylpiperidin-1-yl)methyl]phenyl]methylamino]-4-methylsulfanyl-1-oxidanylidene-butan-2-yl]benzamide Openeye Name: 2-methoxy-N-[1-[[4-[(3-methyl-1-piperidyl)methyl]phenyl]methylcarbamoyl]-3-methylsulfanyl-propyl]benzamide CAS Name: 2-methoxy-N-[1-[[4-[(3-methyl-1-piperidinyl)methyl]phenyl]methylamino]-4-(methylthio)-1-oxobutan-2-yl]benzamide IUPAC Name: 2-methoxy-N-[1-[[4-[(3-methylpiperidin-1-yl)methyl]phenyl]methylamino]-4-methylsulfanyl-1-oxobutan-2-yl]benzamide Traditional Name: 2-methoxy-N-[1-[[4-[(3-methylpiperidino)methyl]benzyl]carbamoyl]-3-(methylthio)propyl]benzamide Formula: C27H37N3O3S MolecularWeight: 483.66598

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCCN(C1)CC2=CC=C(C=C2)CNC(=O)C(CCSC)NC(=O)C3=CC=CC=C3OC

Isomeric SMILES

CC1CCCN(C1)CC2=CC=C(C=C2)CNC(=O)C(CCSC)NC(=O)C3=CC=CC=C3OC

InChI

InChI=1S/C27H37N3O3S/c1-20-7-6-15-30(18-20)19-22-12-10-21(11-13-22)17-28-27(32)24(14-16-34-3)29-26(31)23-8-4-5-9-25(23)33-2/h4-5,8-13,20,24H,6-7,14-19H2,1-3H3,(H,28,32)(H,29,31)