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

Systemtic Name: 6-chloranyl-4-[[5-[(4-methoxyphenyl)amino]-1,3,4-thiadiazol-2-yl]sulfanylmethyl]-7-methyl-chromen-2-one Openeye Name: 6-chloro-4-[[5-(4-methoxyanilino)-1,3,4-thiadiazol-2-yl]sulfanylmethyl]-7-methyl-chromen-2-one CAS Name: 6-chloro-4-[[[5-(4-methoxyanilino)-1,3,4-thiadiazol-2-yl]thio]methyl]-7-methyl-1-benzopyran-2-one IUPAC Name: 6-chloro-4-[[5-(4-methoxyanilino)-1,3,4-thiadiazol-2-yl]sulfanylmethyl]-7-methylchromen-2-one Traditional Name: 6-chloro-7-methyl-4-[[[5-(p-anisidino)-1,3,4-thiadiazol-2-yl]thio]methyl]coumarin Formula: C20H16ClN3O3S2 MolecularWeight: 445.94234

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C2C(=CC(=O)OC2=C1)CSC3=NN=C(S3)NC4=CC=C(C=C4)OC)Cl

Isomeric SMILES

CC1=C(C=C2C(=CC(=O)OC2=C1)CSC3=NN=C(S3)NC4=CC=C(C=C4)OC)Cl

InChI

InChI=1S/C20H16ClN3O3S2/c1-11-7-17-15(9-16(11)21)12(8-18(25)27-17)10-28-20-24-23-19(29-20)22-13-3-5-14(26-2)6-4-13/h3-9H,10H2,1-2H3,(H,22,23)