3-butyl-1-[(6-ethyl-2-oxidanylidene-1H-quinolin-3-yl)methyl]-1-(thiophen-2-ylmethyl)thiourea

Systemtic Name: 3-butyl-1-[(6-ethyl-2-oxidanylidene-1H-quinolin-3-yl)methyl]-1-(thiophen-2-ylmethyl)thiourea Openeye Name: 3-butyl-1-[(6-ethyl-2-oxo-1H-quinolin-3-yl)methyl]-1-(2-thienylmethyl)thiourea CAS Name: 3-butyl-1-[(6-ethyl-2-oxo-1H-quinolin-3-yl)methyl]-1-(thiophen-2-ylmethyl)thiourea IUPAC Name: 3-butyl-1-[(6-ethyl-2-oxo-1H-quinolin-3-yl)methyl]-1-(thiophen-2-ylmethyl)thiourea Traditional Name: 3-butyl-1-[(6-ethyl-2-keto-1H-quinolin-3-yl)methyl]-1-(2-thenyl)thiourea Formula: C22H27N3OS2 MolecularWeight: 413.59928

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Descriptors Computed from Structure

Canonical SMILES:

CCCCNC(=S)N(CC1=CC=CS1)CC2=CC3=C(C=CC(=C3)CC)NC2=O

Isomeric SMILES

CCCCNC(=S)N(CC1=CC=CS1)CC2=CC3=C(C=CC(=C3)CC)NC2=O

InChI

InChI=1S/C22H27N3OS2/c1-3-5-10-23-22(27)25(15-19-7-6-11-28-19)14-18-13-17-12-16(4-2)8-9-20(17)24-21(18)26/h6-9,11-13H,3-5,10,14-15H2,1-2H3,(H,23,27)(H,24,26)