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

Systemtic Name: N-[5-(4-dimethylaminophenyl)-1,3,4-thiadiazol-2-yl]-2-[(3-methylphenyl)carbamoylamino]-3-phenyl-propanamide Openeye Name: N-[5-(4-dimethylaminophenyl)-1,3,4-thiadiazol-2-yl]-2-(m-tolylcarbamoylamino)-3-phenyl-propanamide CAS Name: N-[5-(4-dimethylaminophenyl)-1,3,4-thiadiazol-2-yl]-2-[[(3-methylanilino)-oxomethyl]amino]-3-phenylpropanamide IUPAC Name: N-[5-(4-dimethylaminophenyl)-1,3,4-thiadiazol-2-yl]-2-[(3-methylphenyl)carbamoylamino]-3-phenylpropanamide Traditional Name: N-[5-(4-dimethylaminophenyl)-1,3,4-thiadiazol-2-yl]-2-(m-tolylcarbamoylamino)-3-phenyl-propionamide Formula: C27H28N6O2S MolecularWeight: 500.61522

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)NC(=O)NC(CC2=CC=CC=C2)C(=O)NC3=NN=C(S3)C4=CC=C(C=C4)N(C)C

Isomeric SMILES

CC1=CC(=CC=C1)NC(=O)NC(CC2=CC=CC=C2)C(=O)NC3=NN=C(S3)C4=CC=C(C=C4)N(C)C

InChI

InChI=1S/C27H28N6O2S/c1-18-8-7-11-21(16-18)28-26(35)29-23(17-19-9-5-4-6-10-19)24(34)30-27-32-31-25(36-27)20-12-14-22(15-13-20)33(2)3/h4-16,23H,17H2,1-3H3,(H2,28,29,35)(H,30,32,34)