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

Systemtic Name: 3-[(4-methylphenyl)sulfonylamino]-N-[5-(3-phenylpropyl)-1,3,4-thiadiazol-2-yl]propanamide Openeye Name: N-[5-(3-phenylpropyl)-1,3,4-thiadiazol-2-yl]-3-(p-tolylsulfonylamino)propanamide CAS Name: 3-[(4-methylphenyl)sulfonylamino]-N-[5-(3-phenylpropyl)-1,3,4-thiadiazol-2-yl]propanamide IUPAC Name: 3-[(4-methylphenyl)sulfonylamino]-N-[5-(3-phenylpropyl)-1,3,4-thiadiazol-2-yl]propanamide Traditional Name: N-[5-(3-phenylpropyl)-1,3,4-thiadiazol-2-yl]-3-(tosylamino)propionamide Formula: C21H24N4O3S2 MolecularWeight: 444.57026

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)NCCC(=O)NC2=NN=C(S2)CCCC3=CC=CC=C3

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)NCCC(=O)NC2=NN=C(S2)CCCC3=CC=CC=C3

InChI

InChI=1S/C21H24N4O3S2/c1-16-10-12-18(13-11-16)30(27,28)22-15-14-19(26)23-21-25-24-20(29-21)9-5-8-17-6-3-2-4-7-17/h2-4,6-7,10-13,22H,5,8-9,14-15H2,1H3,(H,23,25,26)