2-(butylcarbamoylamino)-N-[5-(3-methoxyphenyl)-1,3,4-thiadiazol-2-yl]-3-phenyl-propanamide

Systemtic Name: 2-(butylcarbamoylamino)-N-[5-(3-methoxyphenyl)-1,3,4-thiadiazol-2-yl]-3-phenyl-propanamide Openeye Name: 2-(butylcarbamoylamino)-N-[5-(3-methoxyphenyl)-1,3,4-thiadiazol-2-yl]-3-phenyl-propanamide CAS Name: 2-[[butylamino(oxo)methyl]amino]-N-[5-(3-methoxyphenyl)-1,3,4-thiadiazol-2-yl]-3-phenylpropanamide IUPAC Name: 2-(butylcarbamoylamino)-N-[5-(3-methoxyphenyl)-1,3,4-thiadiazol-2-yl]-3-phenylpropanamide Traditional Name: 2-(butylcarbamoylamino)-N-[5-(3-methoxyphenyl)-1,3,4-thiadiazol-2-yl]-3-phenyl-propionamide Formula: C23H27N5O3S MolecularWeight: 453.55718

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Descriptors Computed from Structure

Canonical SMILES:

CCCCNC(=O)NC(CC1=CC=CC=C1)C(=O)NC2=NN=C(S2)C3=CC(=CC=C3)OC

Isomeric SMILES

CCCCNC(=O)NC(CC1=CC=CC=C1)C(=O)NC2=NN=C(S2)C3=CC(=CC=C3)OC

InChI

InChI=1S/C23H27N5O3S/c1-3-4-13-24-22(30)25-19(14-16-9-6-5-7-10-16)20(29)26-23-28-27-21(32-23)17-11-8-12-18(15-17)31-2/h5-12,15,19H,3-4,13-14H2,1-2H3,(H2,24,25,30)(H,26,28,29)