N-[5-[2-[(4-methoxyphenyl)methylamino]-2-oxidanylidene-ethyl]sulfanyl-1,3,4-thiadiazol-2-yl]-3-phenyl-propanamide

Systemtic Name: N-[5-[2-[(4-methoxyphenyl)methylamino]-2-oxidanylidene-ethyl]sulfanyl-1,3,4-thiadiazol-2-yl]-3-phenyl-propanamide Openeye Name: N-[5-[2-[(4-methoxyphenyl)methylamino]-2-oxo-ethyl]sulfanyl-1,3,4-thiadiazol-2-yl]-3-phenyl-propanamide CAS Name: N-[5-[[2-[(4-methoxyphenyl)methylamino]-2-oxoethyl]thio]-1,3,4-thiadiazol-2-yl]-3-phenylpropanamide IUPAC Name: N-[5-[2-[(4-methoxyphenyl)methylamino]-2-oxoethyl]sulfanyl-1,3,4-thiadiazol-2-yl]-3-phenylpropanamide Traditional Name: N-[5-[[2-keto-2-(p-anisylamino)ethyl]thio]-1,3,4-thiadiazol-2-yl]-3-phenyl-propionamide Formula: C21H22N4O3S2 MolecularWeight: 442.55438

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)CNC(=O)CSC2=NN=C(S2)NC(=O)CCC3=CC=CC=C3

Isomeric SMILES

COC1=CC=C(C=C1)CNC(=O)CSC2=NN=C(S2)NC(=O)CCC3=CC=CC=C3

InChI

InChI=1S/C21H22N4O3S2/c1-28-17-10-7-16(8-11-17)13-22-19(27)14-29-21-25-24-20(30-21)23-18(26)12-9-15-5-3-2-4-6-15/h2-8,10-11H,9,12-14H2,1H3,(H,22,27)(H,23,24,26)