2-[(3-cyanophenyl)carbamoylamino]-N-[5-(4-dimethylaminophenyl)-1,3,4-thiadiazol-2-yl]-3-methyl-pentanamide

Systemtic Name: 2-[(3-cyanophenyl)carbamoylamino]-N-[5-(4-dimethylaminophenyl)-1,3,4-thiadiazol-2-yl]-3-methyl-pentanamide Openeye Name: 2-[(3-cyanophenyl)carbamoylamino]-N-[5-(4-dimethylaminophenyl)-1,3,4-thiadiazol-2-yl]-3-methyl-pentanamide CAS Name: 2-[[(3-cyanoanilino)-oxomethyl]amino]-N-[5-(4-dimethylaminophenyl)-1,3,4-thiadiazol-2-yl]-3-methylpentanamide IUPAC Name: 2-[(3-cyanophenyl)carbamoylamino]-N-[5-(4-dimethylaminophenyl)-1,3,4-thiadiazol-2-yl]-3-methylpentanamide Traditional Name: 2-[(3-cyanophenyl)carbamoylamino]-N-[5-(4-dimethylaminophenyl)-1,3,4-thiadiazol-2-yl]-3-methyl-valeramide Formula: C24H27N7O2S MolecularWeight: 477.58188

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)C(C(=O)NC1=NN=C(S1)C2=CC=C(C=C2)N(C)C)NC(=O)NC3=CC=CC(=C3)C#N

Isomeric SMILES

CCC(C)C(C(=O)NC1=NN=C(S1)C2=CC=C(C=C2)N(C)C)NC(=O)NC3=CC=CC(=C3)C#N

InChI

InChI=1S/C24H27N7O2S/c1-5-15(2)20(27-23(33)26-18-8-6-7-16(13-18)14-25)21(32)28-24-30-29-22(34-24)17-9-11-19(12-10-17)31(3)4/h6-13,15,20H,5H2,1-4H3,(H2,26,27,33)(H,28,30,32)