7-chloranyl-2-[[5-(3-ethoxypropylamino)-1,3,4-thiadiazol-2-yl]sulfanylmethyl]-1H-quinazolin-4-one

Systemtic Name: 7-chloranyl-2-[[5-(3-ethoxypropylamino)-1,3,4-thiadiazol-2-yl]sulfanylmethyl]-1H-quinazolin-4-one Openeye Name: 7-chloro-2-[[5-(3-ethoxypropylamino)-1,3,4-thiadiazol-2-yl]sulfanylmethyl]-1H-quinazolin-4-one CAS Name: 7-chloro-2-[[[5-(3-ethoxypropylamino)-1,3,4-thiadiazol-2-yl]thio]methyl]-1H-quinazolin-4-one IUPAC Name: 7-chloro-2-[[5-(3-ethoxypropylamino)-1,3,4-thiadiazol-2-yl]sulfanylmethyl]-1H-quinazolin-4-one Traditional Name: 7-chloro-2-[[[5-(3-ethoxypropylamino)-1,3,4-thiadiazol-2-yl]thio]methyl]-1H-quinazolin-4-one Formula: C16H18ClN5O2S2 MolecularWeight: 411.92942

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Descriptors Computed from Structure

Canonical SMILES:

CCOCCCNC1=NN=C(S1)SCC2=NC(=O)C3=C(N2)C=C(C=C3)Cl

Isomeric SMILES

CCOCCCNC1=NN=C(S1)SCC2=NC(=O)C3=C(N2)C=C(C=C3)Cl

InChI

InChI=1S/C16H18ClN5O2S2/c1-2-24-7-3-6-18-15-21-22-16(26-15)25-9-13-19-12-8-10(17)4-5-11(12)14(23)20-13/h4-5,8H,2-3,6-7,9H2,1H3,(H,18,21)(H,19,20,23)