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

Systemtic Name: 7-methyl-4-[[5-(methylamino)-1,3,4-thiadiazol-2-yl]sulfanylmethyl]-6-propan-2-yl-chromen-2-one Openeye Name: 6-isopropyl-7-methyl-4-[[5-(methylamino)-1,3,4-thiadiazol-2-yl]sulfanylmethyl]chromen-2-one CAS Name: 7-methyl-4-[[[5-(methylamino)-1,3,4-thiadiazol-2-yl]thio]methyl]-6-propan-2-yl-1-benzopyran-2-one IUPAC Name: 7-methyl-4-[[5-(methylamino)-1,3,4-thiadiazol-2-yl]sulfanylmethyl]-6-propan-2-ylchromen-2-one Traditional Name: 6-isopropyl-7-methyl-4-[[[5-(methylamino)-1,3,4-thiadiazol-2-yl]thio]methyl]coumarin Formula: C17H19N3O2S2 MolecularWeight: 361.48166

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C2C(=CC(=O)OC2=C1)CSC3=NN=C(S3)NC)C(C)C

Isomeric SMILES

CC1=C(C=C2C(=CC(=O)OC2=C1)CSC3=NN=C(S3)NC)C(C)C

InChI

InChI=1S/C17H19N3O2S2/c1-9(2)12-7-13-11(6-15(21)22-14(13)5-10(12)3)8-23-17-20-19-16(18-4)24-17/h5-7,9H,8H2,1-4H3,(H,18,19)