1-[5-(7-chloranylquinolin-4-yl)sulfanyl-1,3,4-thiadiazol-2-yl]-3-(phenylmethyl)urea

Systemtic Name: 1-[5-(7-chloranylquinolin-4-yl)sulfanyl-1,3,4-thiadiazol-2-yl]-3-(phenylmethyl)urea Openeye Name: 1-benzyl-3-[5-[(7-chloro-4-quinolyl)sulfanyl]-1,3,4-thiadiazol-2-yl]urea CAS Name: 1-[5-[(7-chloro-4-quinolinyl)thio]-1,3,4-thiadiazol-2-yl]-3-(phenylmethyl)urea IUPAC Name: 1-benzyl-3-[5-(7-chloroquinolin-4-yl)sulfanyl-1,3,4-thiadiazol-2-yl]urea Traditional Name: 1-benzyl-3-[5-[(7-chloro-4-quinolyl)thio]-1,3,4-thiadiazol-2-yl]urea Formula: C19H14ClN5OS2 MolecularWeight: 427.93036

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CNC(=O)NC2=NN=C(S2)SC3=C4C=CC(=CC4=NC=C3)Cl

Isomeric SMILES

C1=CC=C(C=C1)CNC(=O)NC2=NN=C(S2)SC3=C4C=CC(=CC4=NC=C3)Cl

InChI

InChI=1S/C19H14ClN5OS2/c20-13-6-7-14-15(10-13)21-9-8-16(14)27-19-25-24-18(28-19)23-17(26)22-11-12-4-2-1-3-5-12/h1-10H,11H2,(H2,22,23,24,26)