5-methylsulfanyl-4-[2-[[4-(phenylmethyl)phenyl]amino]-1,3-thiazol-4-yl]thiophene-2-carboximidamide

Systemtic Name: 5-methylsulfanyl-4-[2-[[4-(phenylmethyl)phenyl]amino]-1,3-thiazol-4-yl]thiophene-2-carboximidamide Openeye Name: 4-[2-(4-benzylanilino)thiazol-4-yl]-5-methylsulfanyl-thiophene-2-carboxamidine CAS Name: 5-(methylthio)-4-[2-[4-(phenylmethyl)anilino]-4-thiazolyl]-2-thiophenecarboximidamide IUPAC Name: 4-[2-(4-benzylanilino)-1,3-thiazol-4-yl]-5-methylsulfanylthiophene-2-carboximidamide Traditional Name: 4-[2-(4-benzylanilino)thiazol-4-yl]-5-(methylthio)thiophene-2-carboxamidine Formula: C22H20N4S3 MolecularWeight: 436.616

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=C(C=C(S1)C(=N)N)C2=CSC(=N2)NC3=CC=C(C=C3)CC4=CC=CC=C4

Isomeric SMILES

CSC1=C(C=C(S1)C(=N)N)C2=CSC(=N2)NC3=CC=C(C=C3)CC4=CC=CC=C4

InChI

InChI=1S/C22H20N4S3/c1-27-21-17(12-19(29-21)20(23)24)18-13-28-22(26-18)25-16-9-7-15(8-10-16)11-14-5-3-2-4-6-14/h2-10,12-13H,11H2,1H3,(H3,23,24)(H,25,26)