3-(phenylcarbamoylamino)-N-[5-(4-propan-2-ylphenyl)-1,3,4-thiadiazol-2-yl]propanamide

Systemtic Name: 3-(phenylcarbamoylamino)-N-[5-(4-propan-2-ylphenyl)-1,3,4-thiadiazol-2-yl]propanamide Openeye Name: N-[5-(4-isopropylphenyl)-1,3,4-thiadiazol-2-yl]-3-(phenylcarbamoylamino)propanamide CAS Name: 3-[[anilino(oxo)methyl]amino]-N-[5-(4-propan-2-ylphenyl)-1,3,4-thiadiazol-2-yl]propanamide IUPAC Name: 3-(phenylcarbamoylamino)-N-[5-(4-propan-2-ylphenyl)-1,3,4-thiadiazol-2-yl]propanamide Traditional Name: N-(5-p-cumenyl-1,3,4-thiadiazol-2-yl)-3-(phenylcarbamoylamino)propionamide Formula: C21H23N5O2S MolecularWeight: 409.50462

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC=C(C=C1)C2=NN=C(S2)NC(=O)CCNC(=O)NC3=CC=CC=C3

Isomeric SMILES

CC(C)C1=CC=C(C=C1)C2=NN=C(S2)NC(=O)CCNC(=O)NC3=CC=CC=C3

InChI

InChI=1S/C21H23N5O2S/c1-14(2)15-8-10-16(11-9-15)19-25-26-21(29-19)24-18(27)12-13-22-20(28)23-17-6-4-3-5-7-17/h3-11,14H,12-13H2,1-2H3,(H2,22,23,28)(H,24,26,27)