N-[3-[[5-(4-chlorophenyl)-1,3,4-thiadiazol-2-yl]amino]-3-oxidanylidene-propyl]-N-[2-(3,4-dimethoxyphenyl)ethyl]-3-methoxy-benzamide

Systemtic Name: N-[3-[[5-(4-chlorophenyl)-1,3,4-thiadiazol-2-yl]amino]-3-oxidanylidene-propyl]-N-[2-(3,4-dimethoxyphenyl)ethyl]-3-methoxy-benzamide Openeye Name: N-[3-[[5-(4-chlorophenyl)-1,3,4-thiadiazol-2-yl]amino]-3-oxo-propyl]-N-[2-(3,4-dimethoxyphenyl)ethyl]-3-methoxy-benzamide CAS Name: N-[3-[[5-(4-chlorophenyl)-1,3,4-thiadiazol-2-yl]amino]-3-oxopropyl]-N-[2-(3,4-dimethoxyphenyl)ethyl]-3-methoxybenzamide IUPAC Name: N-[3-[[5-(4-chlorophenyl)-1,3,4-thiadiazol-2-yl]amino]-3-oxopropyl]-N-[2-(3,4-dimethoxyphenyl)ethyl]-3-methoxybenzamide Traditional Name: N-[3-[[5-(4-chlorophenyl)-1,3,4-thiadiazol-2-yl]amino]-3-keto-propyl]-N-homoveratryl-3-methoxy-benzamide Formula: C29H29ClN4O5S MolecularWeight: 581.08236

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)CCN(CCC(=O)NC2=NN=C(S2)C3=CC=C(C=C3)Cl)C(=O)C4=CC(=CC=C4)OC)OC

Isomeric SMILES

COC1=C(C=C(C=C1)CCN(CCC(=O)NC2=NN=C(S2)C3=CC=C(C=C3)Cl)C(=O)C4=CC(=CC=C4)OC)OC

InChI

InChI=1S/C29H29ClN4O5S/c1-37-23-6-4-5-21(18-23)28(36)34(15-13-19-7-12-24(38-2)25(17-19)39-3)16-14-26(35)31-29-33-32-27(40-29)20-8-10-22(30)11-9-20/h4-12,17-18H,13-16H2,1-3H3,(H,31,33,35)