4-acetamido-N-[2-(4-ethylsulfanyl-6-isocyano-1,2,3,4-tetrahydroquinolin-2-yl)-2-methyl-propyl]benzamide

Systemtic Name: 4-acetamido-N-[2-(4-ethylsulfanyl-6-isocyano-1,2,3,4-tetrahydroquinolin-2-yl)-2-methyl-propyl]benzamide Openeye Name: 4-acetamido-N-[2-(4-ethylsulfanyl-6-isocyano-1,2,3,4-tetrahydroquinolin-2-yl)-2-methyl-propyl]benzamide CAS Name: 4-acetamido-N-[2-[4-(ethylthio)-6-isocyano-1,2,3,4-tetrahydroquinolin-2-yl]-2-methylpropyl]benzamide IUPAC Name: 4-acetamido-N-[2-(4-ethylsulfanyl-6-isocyano-1,2,3,4-tetrahydroquinolin-2-yl)-2-methylpropyl]benzamide Traditional Name: 4-acetamido-N-[2-[4-(ethylthio)-6-isocyano-1,2,3,4-tetrahydroquinolin-2-yl]-2-methyl-propyl]benzamide Formula: C25H30N4O2S MolecularWeight: 450.5963

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Descriptors Computed from Structure

Canonical SMILES:

CCSC1CC(NC2=C1C=C(C=C2)[N+]#[C-])C(C)(C)CNC(=O)C3=CC=C(C=C3)NC(=O)C

Isomeric SMILES

CCSC1CC(NC2=C1C=C(C=C2)[N+]#[C-])C(C)(C)CNC(=O)C3=CC=C(C=C3)NC(=O)C

InChI

InChI=1S/C25H30N4O2S/c1-6-32-22-14-23(29-21-12-11-19(26-5)13-20(21)22)25(3,4)15-27-24(31)17-7-9-18(10-8-17)28-16(2)30/h7-13,22-23,29H,6,14-15H2,1-4H3,(H,27,31)(H,28,30)