1-(3-methylbutyl)-3-[(Z)-1-[3-(2-oxidanylidenepyrrolidin-1-yl)phenyl]ethylideneamino]thiourea

Systemtic Name: 1-(3-methylbutyl)-3-[(Z)-1-[3-(2-oxidanylidenepyrrolidin-1-yl)phenyl]ethylideneamino]thiourea Openeye Name: 1-isopentyl-3-[(Z)-1-[3-(2-oxopyrrolidin-1-yl)phenyl]ethylideneamino]thiourea CAS Name: 1-(3-methylbutyl)-3-[(Z)-1-[3-(2-oxo-1-pyrrolidinyl)phenyl]ethylideneamino]thiourea IUPAC Name: 1-(3-methylbutyl)-3-[(Z)-1-[3-(2-oxopyrrolidin-1-yl)phenyl]ethylideneamino]thiourea Traditional Name: 1-isoamyl-3-[(Z)-1-[3-(2-ketopyrrolidino)phenyl]ethylideneamino]thiourea Formula: C18H26N4OS MolecularWeight: 346.49024

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCNC(=S)NN=C(C)C1=CC(=CC=C1)N2CCCC2=O

Isomeric SMILES

CC(C)CCNC(=S)N/N=C(/C)\C1=CC(=CC=C1)N2CCCC2=O

InChI

InChI=1S/C18H26N4OS/c1-13(2)9-10-19-18(24)21-20-14(3)15-6-4-7-16(12-15)22-11-5-8-17(22)23/h4,6-7,12-13H,5,8-11H2,1-3H3,(H2,19,21,24)/b20-14-