4-(4-chlorophenyl)sulfanyl-N-[4-(2-oxidanylidenechromen-3-yl)-1,3-thiazol-2-yl]butanamide

Systemtic Name: 4-(4-chlorophenyl)sulfanyl-N-[4-(2-oxidanylidenechromen-3-yl)-1,3-thiazol-2-yl]butanamide Openeye Name: 4-(4-chlorophenyl)sulfanyl-N-[4-(2-oxochromen-3-yl)thiazol-2-yl]butanamide CAS Name: 4-[(4-chlorophenyl)thio]-N-[4-(2-oxo-1-benzopyran-3-yl)-2-thiazolyl]butanamide IUPAC Name: 4-(4-chlorophenyl)sulfanyl-N-[4-(2-oxochromen-3-yl)-1,3-thiazol-2-yl]butanamide Traditional Name: 4-[(4-chlorophenyl)thio]-N-[4-(2-ketochromen-3-yl)thiazol-2-yl]butyramide Formula: C22H17ClN2O3S2 MolecularWeight: 456.96498

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C=C(C(=O)O2)C3=CSC(=N3)NC(=O)CCCSC4=CC=C(C=C4)Cl

Isomeric SMILES

C1=CC=C2C(=C1)C=C(C(=O)O2)C3=CSC(=N3)NC(=O)CCCSC4=CC=C(C=C4)Cl

InChI

InChI=1S/C22H17ClN2O3S2/c23-15-7-9-16(10-8-15)29-11-3-6-20(26)25-22-24-18(13-30-22)17-12-14-4-1-2-5-19(14)28-21(17)27/h1-2,4-5,7-10,12-13H,3,6,11H2,(H,24,25,26)