6-chloranyl-7-methyl-4-[[5-(propylamino)-1,3,4-thiadiazol-2-yl]sulfanylmethyl]chromen-2-one

Systemtic Name: 6-chloranyl-7-methyl-4-[[5-(propylamino)-1,3,4-thiadiazol-2-yl]sulfanylmethyl]chromen-2-one Openeye Name: 6-chloro-7-methyl-4-[[5-(propylamino)-1,3,4-thiadiazol-2-yl]sulfanylmethyl]chromen-2-one CAS Name: 6-chloro-7-methyl-4-[[[5-(propylamino)-1,3,4-thiadiazol-2-yl]thio]methyl]-1-benzopyran-2-one IUPAC Name: 6-chloro-7-methyl-4-[[5-(propylamino)-1,3,4-thiadiazol-2-yl]sulfanylmethyl]chromen-2-one Traditional Name: 6-chloro-7-methyl-4-[[[5-(propylamino)-1,3,4-thiadiazol-2-yl]thio]methyl]coumarin Formula: C16H16ClN3O2S2 MolecularWeight: 381.90014

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Descriptors Computed from Structure

Canonical SMILES:

CCCNC1=NN=C(S1)SCC2=CC(=O)OC3=CC(=C(C=C23)Cl)C

Isomeric SMILES

CCCNC1=NN=C(S1)SCC2=CC(=O)OC3=CC(=C(C=C23)Cl)C

InChI

InChI=1S/C16H16ClN3O2S2/c1-3-4-18-15-19-20-16(24-15)23-8-10-6-14(21)22-13-5-9(2)12(17)7-11(10)13/h5-7H,3-4,8H2,1-2H3,(H,18,19)