4-butyl-N-[3-[[5-(4-methoxyphenyl)-1,3,4-thiadiazol-2-yl]amino]-3-oxidanylidene-propyl]-N-phenethyl-benzamide

Systemtic Name: 4-butyl-N-[3-[[5-(4-methoxyphenyl)-1,3,4-thiadiazol-2-yl]amino]-3-oxidanylidene-propyl]-N-phenethyl-benzamide Openeye Name: 4-butyl-N-[3-[[5-(4-methoxyphenyl)-1,3,4-thiadiazol-2-yl]amino]-3-oxo-propyl]-N-phenethyl-benzamide CAS Name: 4-butyl-N-[3-[[5-(4-methoxyphenyl)-1,3,4-thiadiazol-2-yl]amino]-3-oxopropyl]-N-phenethylbenzamide IUPAC Name: 4-butyl-N-[3-[[5-(4-methoxyphenyl)-1,3,4-thiadiazol-2-yl]amino]-3-oxopropyl]-N-phenethylbenzamide Traditional Name: 4-butyl-N-[3-keto-3-[[5-(4-methoxyphenyl)-1,3,4-thiadiazol-2-yl]amino]propyl]-N-phenethyl-benzamide Formula: C31H34N4O3S MolecularWeight: 542.69166

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=CC=C(C=C1)C(=O)N(CCC2=CC=CC=C2)CCC(=O)NC3=NN=C(S3)C4=CC=C(C=C4)OC

Isomeric SMILES

CCCCC1=CC=C(C=C1)C(=O)N(CCC2=CC=CC=C2)CCC(=O)NC3=NN=C(S3)C4=CC=C(C=C4)OC

InChI

InChI=1S/C31H34N4O3S/c1-3-4-8-24-11-13-26(14-12-24)30(37)35(21-19-23-9-6-5-7-10-23)22-20-28(36)32-31-34-33-29(39-31)25-15-17-27(38-2)18-16-25/h5-7,9-18H,3-4,8,19-22H2,1-2H3,(H,32,34,36)