2-[[5-[(3-methylphenyl)amino]-1,3,4-thiadiazol-2-yl]sulfanylmethyl]-1H-quinazolin-4-one

Systemtic Name: 2-[[5-[(3-methylphenyl)amino]-1,3,4-thiadiazol-2-yl]sulfanylmethyl]-1H-quinazolin-4-one Openeye Name: 2-[[5-(3-methylanilino)-1,3,4-thiadiazol-2-yl]sulfanylmethyl]-1H-quinazolin-4-one CAS Name: 2-[[[5-(3-methylanilino)-1,3,4-thiadiazol-2-yl]thio]methyl]-1H-quinazolin-4-one IUPAC Name: 2-[[5-(3-methylanilino)-1,3,4-thiadiazol-2-yl]sulfanylmethyl]-1H-quinazolin-4-one Traditional Name: 2-[[[5-(m-toluidino)-1,3,4-thiadiazol-2-yl]thio]methyl]-1H-quinazolin-4-one Formula: C18H15N5OS2 MolecularWeight: 381.4746

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)NC2=NN=C(S2)SCC3=NC(=O)C4=CC=CC=C4N3

Isomeric SMILES

CC1=CC(=CC=C1)NC2=NN=C(S2)SCC3=NC(=O)C4=CC=CC=C4N3

InChI

InChI=1S/C18H15N5OS2/c1-11-5-4-6-12(9-11)19-17-22-23-18(26-17)25-10-15-20-14-8-3-2-7-13(14)16(24)21-15/h2-9H,10H2,1H3,(H,19,22)(H,20,21,24)