3-methyl-N-[4-methylsulfanyl-1-oxidanylidene-1-(4-propan-2-ylpiperazin-1-yl)butan-2-yl]benzamide

Systemtic Name: 3-methyl-N-[4-methylsulfanyl-1-oxidanylidene-1-(4-propan-2-ylpiperazin-1-yl)butan-2-yl]benzamide Openeye Name: N-[1-(4-isopropylpiperazine-1-carbonyl)-3-methylsulfanyl-propyl]-3-methyl-benzamide CAS Name: 3-methyl-N-[4-(methylthio)-1-oxo-1-(4-propan-2-yl-1-piperazinyl)butan-2-yl]benzamide IUPAC Name: 3-methyl-N-[4-methylsulfanyl-1-oxo-1-(4-propan-2-ylpiperazin-1-yl)butan-2-yl]benzamide Traditional Name: N-[1-(4-isopropylpiperazine-1-carbonyl)-3-(methylthio)propyl]-3-methyl-benzamide Formula: C20H31N3O2S MolecularWeight: 377.54404

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC(=C1)C(=O)NC(CCSC)C(=O)N2CCN(CC2)C(C)C

Isomeric SMILES

CC1=CC=CC(=C1)C(=O)NC(CCSC)C(=O)N2CCN(CC2)C(C)C

InChI

InChI=1S/C20H31N3O2S/c1-15(2)22-9-11-23(12-10-22)20(25)18(8-13-26-4)21-19(24)17-7-5-6-16(3)14-17/h5-7,14-15,18H,8-13H2,1-4H3,(H,21,24)