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

Systemtic Name: 2-(cyclohexylcarbamoylamino)-N-[5-(4-methylphenyl)-1,3,4-thiadiazol-2-yl]-3-phenyl-propanamide Openeye Name: 2-(cyclohexylcarbamoylamino)-3-phenyl-N-[5-(p-tolyl)-1,3,4-thiadiazol-2-yl]propanamide CAS Name: 2-[[(cyclohexylamino)-oxomethyl]amino]-N-[5-(4-methylphenyl)-1,3,4-thiadiazol-2-yl]-3-phenylpropanamide IUPAC Name: 2-(cyclohexylcarbamoylamino)-N-[5-(4-methylphenyl)-1,3,4-thiadiazol-2-yl]-3-phenylpropanamide Traditional Name: 2-(cyclohexylcarbamoylamino)-3-phenyl-N-[5-(p-tolyl)-1,3,4-thiadiazol-2-yl]propionamide Formula: C25H29N5O2S MolecularWeight: 463.59506

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=NN=C(S2)NC(=O)C(CC3=CC=CC=C3)NC(=O)NC4CCCCC4

Isomeric SMILES

CC1=CC=C(C=C1)C2=NN=C(S2)NC(=O)C(CC3=CC=CC=C3)NC(=O)NC4CCCCC4

InChI

InChI=1S/C25H29N5O2S/c1-17-12-14-19(15-13-17)23-29-30-25(33-23)28-22(31)21(16-18-8-4-2-5-9-18)27-24(32)26-20-10-6-3-7-11-20/h2,4-5,8-9,12-15,20-21H,3,6-7,10-11,16H2,1H3,(H2,26,27,32)(H,28,30,31)