N-[5-[(4-chlorophenyl)methylsulfanyl]-1,3,4-thiadiazol-2-yl]-3-(4-oxidanylidene-1H-quinazolin-2-yl)propanamide

Systemtic Name: N-[5-[(4-chlorophenyl)methylsulfanyl]-1,3,4-thiadiazol-2-yl]-3-(4-oxidanylidene-1H-quinazolin-2-yl)propanamide Openeye Name: N-[5-[(4-chlorophenyl)methylsulfanyl]-1,3,4-thiadiazol-2-yl]-3-(4-oxo-1H-quinazolin-2-yl)propanamide CAS Name: N-[5-[(4-chlorophenyl)methylthio]-1,3,4-thiadiazol-2-yl]-3-(4-oxo-1H-quinazolin-2-yl)propanamide IUPAC Name: N-[5-[(4-chlorophenyl)methylsulfanyl]-1,3,4-thiadiazol-2-yl]-3-(4-oxo-1H-quinazolin-2-yl)propanamide Traditional Name: N-[5-[(4-chlorobenzyl)thio]-1,3,4-thiadiazol-2-yl]-3-(4-keto-1H-quinazolin-2-yl)propionamide Formula: C20H16ClN5O2S2 MolecularWeight: 457.95634

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=O)N=C(N2)CCC(=O)NC3=NN=C(S3)SCC4=CC=C(C=C4)Cl

Isomeric SMILES

C1=CC=C2C(=C1)C(=O)N=C(N2)CCC(=O)NC3=NN=C(S3)SCC4=CC=C(C=C4)Cl

InChI

InChI=1S/C20H16ClN5O2S2/c21-13-7-5-12(6-8-13)11-29-20-26-25-19(30-20)24-17(27)10-9-16-22-15-4-2-1-3-14(15)18(28)23-16/h1-8H,9-11H2,(H,22,23,28)(H,24,25,27)