6-chloranyl-7-ethyl-4-[[(2E)-2-indol-3-ylidene-3H-1,3,4-oxadiazol-5-yl]sulfanylmethyl]chromen-2-one

Systemtic Name: 6-chloranyl-7-ethyl-4-[[(2E)-2-indol-3-ylidene-3H-1,3,4-oxadiazol-5-yl]sulfanylmethyl]chromen-2-one Openeye Name: 6-chloro-7-ethyl-4-[[(2E)-2-indol-3-ylidene-3H-1,3,4-oxadiazol-5-yl]sulfanylmethyl]chromen-2-one CAS Name: 6-chloro-7-ethyl-4-[[[(2E)-2-(3-indolylidene)-3H-1,3,4-oxadiazol-5-yl]thio]methyl]-1-benzopyran-2-one IUPAC Name: 6-chloro-7-ethyl-4-[[(2E)-2-indol-3-ylidene-3H-1,3,4-oxadiazol-5-yl]sulfanylmethyl]chromen-2-one Traditional Name: 6-chloro-7-ethyl-4-[[[(2E)-2-indol-3-ylidene-3H-1,3,4-oxadiazol-5-yl]thio]methyl]coumarin Formula: C22H16ClN3O3S MolecularWeight: 437.89874

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C=C2C(=CC(=O)OC2=C1)CSC3=NNC(=C4C=NC5=CC=CC=C54)O3)Cl

Isomeric SMILES

CCC1=C(C=C2C(=CC(=O)OC2=C1)CSC3=NN/C(=C/4\C=NC5=CC=CC=C54)/O3)Cl

InChI

InChI=1S/C22H16ClN3O3S/c1-2-12-7-19-15(9-17(12)23)13(8-20(27)28-19)11-30-22-26-25-21(29-22)16-10-24-18-6-4-3-5-14(16)18/h3-10,25H,2,11H2,1H3/b21-16-