1-phenethyl-3-(2-quinolin-8-ylsulfanylethanoylamino)thiourea

Systemtic Name: 1-phenethyl-3-(2-quinolin-8-ylsulfanylethanoylamino)thiourea Openeye Name: 1-phenethyl-3-[[2-(8-quinolylsulfanyl)acetyl]amino]thiourea CAS Name: 1-[[1-oxo-2-(8-quinolinylthio)ethyl]amino]-3-phenethylthiourea IUPAC Name: 1-phenethyl-3-[(2-quinolin-8-ylsulfanylacetyl)amino]thiourea Traditional Name: 1-phenethyl-3-[[2-(8-quinolylthio)acetyl]amino]thiourea Formula: C20H20N4OS2 MolecularWeight: 396.529

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CCNC(=S)NNC(=O)CSC2=CC=CC3=C2N=CC=C3

Isomeric SMILES

C1=CC=C(C=C1)CCNC(=S)NNC(=O)CSC2=CC=CC3=C2N=CC=C3

InChI

InChI=1S/C20H20N4OS2/c25-18(14-27-17-10-4-8-16-9-5-12-21-19(16)17)23-24-20(26)22-13-11-15-6-2-1-3-7-15/h1-10,12H,11,13-14H2,(H,23,25)(H2,22,24,26)