5-azanylidene-2-methyl-N-phenyl-4-propylsulfanyl-9bH-thiopyrano[4,3-a]pyrrolizine-1-carboxamide

Systemtic Name: 5-azanylidene-2-methyl-N-phenyl-4-propylsulfanyl-9bH-thiopyrano[4,3-a]pyrrolizine-1-carboxamide Openeye Name: 5-imino-2-methyl-N-phenyl-4-propylsulfanyl-9bH-thiopyrano[4,3-a]pyrrolizine-1-carboxamide CAS Name: 5-imino-2-methyl-N-phenyl-4-(propylthio)-9bH-thiopyrano[4,3-a]pyrrolizine-1-carboxamide IUPAC Name: 5-imino-2-methyl-N-phenyl-4-propylsulfanyl-9bH-thiopyrano[4,3-a]pyrrolizine-1-carboxamide Traditional Name: 5-imino-2-methyl-N-phenyl-4-(propylthio)-9bH-thiopyrano[4,3-a]pyrrolizine-1-carboxamide Formula: C21H21N3OS2 MolecularWeight: 395.54094

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Descriptors Computed from Structure

Canonical SMILES:

CCCSC1=C2C(C3=CC=CN3C2=N)C(=C(S1)C)C(=O)NC4=CC=CC=C4

Isomeric SMILES

CCCSC1=C2C(C3=CC=CN3C2=N)C(=C(S1)C)C(=O)NC4=CC=CC=C4

InChI

InChI=1S/C21H21N3OS2/c1-3-12-26-21-18-17(15-10-7-11-24(15)19(18)22)16(13(2)27-21)20(25)23-14-8-5-4-6-9-14/h4-11,17,22H,3,12H2,1-2H3,(H,23,25)