2-[1-[[5-(butylamino)-1,3,4-thiadiazol-2-yl]sulfanyl]ethyl]-1H-quinazolin-4-one

Systemtic Name: 2-[1-[[5-(butylamino)-1,3,4-thiadiazol-2-yl]sulfanyl]ethyl]-1H-quinazolin-4-one Openeye Name: 2-[1-[[5-(butylamino)-1,3,4-thiadiazol-2-yl]sulfanyl]ethyl]-1H-quinazolin-4-one CAS Name: 2-[1-[[5-(butylamino)-1,3,4-thiadiazol-2-yl]thio]ethyl]-1H-quinazolin-4-one IUPAC Name: 2-[1-[[5-(butylamino)-1,3,4-thiadiazol-2-yl]sulfanyl]ethyl]-1H-quinazolin-4-one Traditional Name: 2-[1-[[5-(butylamino)-1,3,4-thiadiazol-2-yl]thio]ethyl]-1H-quinazolin-4-one Formula: C16H19N5OS2 MolecularWeight: 361.48496

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Descriptors Computed from Structure

Canonical SMILES:

CCCCNC1=NN=C(S1)SC(C)C2=NC(=O)C3=CC=CC=C3N2

Isomeric SMILES

CCCCNC1=NN=C(S1)SC(C)C2=NC(=O)C3=CC=CC=C3N2

InChI

InChI=1S/C16H19N5OS2/c1-3-4-9-17-15-20-21-16(24-15)23-10(2)13-18-12-8-6-5-7-11(12)14(22)19-13/h5-8,10H,3-4,9H2,1-2H3,(H,17,20)(H,18,19,22)