2-[(5-butylsulfanyl-1,3,4-thiadiazol-2-yl)sulfanylmethyl]-8-methyl-1H-quinazolin-4-one

Systemtic Name: 2-[(5-butylsulfanyl-1,3,4-thiadiazol-2-yl)sulfanylmethyl]-8-methyl-1H-quinazolin-4-one Openeye Name: 2-[(5-butylsulfanyl-1,3,4-thiadiazol-2-yl)sulfanylmethyl]-8-methyl-1H-quinazolin-4-one CAS Name: 2-[[[5-(butylthio)-1,3,4-thiadiazol-2-yl]thio]methyl]-8-methyl-1H-quinazolin-4-one IUPAC Name: 2-[(5-butylsulfanyl-1,3,4-thiadiazol-2-yl)sulfanylmethyl]-8-methyl-1H-quinazolin-4-one Traditional Name: 2-[[[5-(butylthio)-1,3,4-thiadiazol-2-yl]thio]methyl]-8-methyl-1H-quinazolin-4-one Formula: C16H18N4OS3 MolecularWeight: 378.53532

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Descriptors Computed from Structure

Canonical SMILES:

CCCCSC1=NN=C(S1)SCC2=NC(=O)C3=C(N2)C(=CC=C3)C

Isomeric SMILES

CCCCSC1=NN=C(S1)SCC2=NC(=O)C3=C(N2)C(=CC=C3)C

InChI

InChI=1S/C16H18N4OS3/c1-3-4-8-22-15-19-20-16(24-15)23-9-12-17-13-10(2)6-5-7-11(13)14(21)18-12/h5-7H,3-4,8-9H2,1-2H3,(H,17,18,21)