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

Systemtic Name: 2-[(4-cyanophenyl)carbamoylamino]-N-[5-(4-methoxyphenyl)-1,3,4-thiadiazol-2-yl]-3-methyl-butanamide Openeye Name: 2-[(4-cyanophenyl)carbamoylamino]-N-[5-(4-methoxyphenyl)-1,3,4-thiadiazol-2-yl]-3-methyl-butanamide CAS Name: 2-[[(4-cyanoanilino)-oxomethyl]amino]-N-[5-(4-methoxyphenyl)-1,3,4-thiadiazol-2-yl]-3-methylbutanamide IUPAC Name: 2-[(4-cyanophenyl)carbamoylamino]-N-[5-(4-methoxyphenyl)-1,3,4-thiadiazol-2-yl]-3-methylbutanamide Traditional Name: 2-[(4-cyanophenyl)carbamoylamino]-N-[5-(4-methoxyphenyl)-1,3,4-thiadiazol-2-yl]-3-methyl-butyramide Formula: C22H22N6O3S MolecularWeight: 450.51348

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H22N6O3S/c1-13(2)18(25-21(30)24-16-8-4-14(12-23)5-9-16)19(29)26-22-28-27-20(32-22)15-6-10-17(31-3)11-7-15/h4-11,13,18H,1-3H3,(H2,24,25,30)(H,26,28,29)