5-azanylidene-4-[(4-chlorophenyl)methylsulfanyl]-2-methyl-N-phenyl-9bH-pyrano[4,3-a]pyrrolizine-1-carboxamide

Systemtic Name: 5-azanylidene-4-[(4-chlorophenyl)methylsulfanyl]-2-methyl-N-phenyl-9bH-pyrano[4,3-a]pyrrolizine-1-carboxamide Openeye Name: 4-[(4-chlorophenyl)methylsulfanyl]-5-imino-2-methyl-N-phenyl-9bH-pyrano[4,3-a]pyrrolizine-1-carboxamide CAS Name: 4-[(4-chlorophenyl)methylthio]-5-imino-2-methyl-N-phenyl-9bH-pyrano[4,3-a]pyrrolizine-1-carboxamide IUPAC Name: 4-[(4-chlorophenyl)methylsulfanyl]-5-imino-2-methyl-N-phenyl-9bH-pyrano[4,3-a]pyrrolizine-1-carboxamide Traditional Name: 4-[(4-chlorobenzyl)thio]-5-imino-2-methyl-N-phenyl-9bH-pyrano[4,3-a]pyrrolizine-1-carboxamide Formula: C25H20ClN3O2S MolecularWeight: 461.9632

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C2C3=CC=CN3C(=N)C2=C(O1)SCC4=CC=C(C=C4)Cl)C(=O)NC5=CC=CC=C5

Isomeric SMILES

CC1=C(C2C3=CC=CN3C(=N)C2=C(O1)SCC4=CC=C(C=C4)Cl)C(=O)NC5=CC=CC=C5

InChI

InChI=1S/C25H20ClN3O2S/c1-15-20(24(30)28-18-6-3-2-4-7-18)21-19-8-5-13-29(19)23(27)22(21)25(31-15)32-14-16-9-11-17(26)12-10-16/h2-13,21,27H,14H2,1H3,(H,28,30)