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

Systemtic Name: 2-(1-adamantylcarbamoylamino)-N-[5-(4-methoxyphenyl)-1,3,4-thiadiazol-2-yl]-3-methyl-butanamide Openeye Name: 2-(1-adamantylcarbamoylamino)-N-[5-(4-methoxyphenyl)-1,3,4-thiadiazol-2-yl]-3-methyl-butanamide CAS Name: 2-[[(1-adamantylamino)-oxomethyl]amino]-N-[5-(4-methoxyphenyl)-1,3,4-thiadiazol-2-yl]-3-methylbutanamide IUPAC Name: 2-(1-adamantylcarbamoylamino)-N-[5-(4-methoxyphenyl)-1,3,4-thiadiazol-2-yl]-3-methylbutanamide Traditional Name: 2-(1-adamantylcarbamoylamino)-N-[5-(4-methoxyphenyl)-1,3,4-thiadiazol-2-yl]-3-methyl-butyramide Formula: C25H33N5O3S MolecularWeight: 483.62622

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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)NC34CC5CC(C3)CC(C5)C4

Isomeric SMILES

CC(C)C(C(=O)NC1=NN=C(S1)C2=CC=C(C=C2)OC)NC(=O)NC34CC5CC(C3)CC(C5)C4

InChI

InChI=1S/C25H33N5O3S/c1-14(2)20(26-23(32)28-25-11-15-8-16(12-25)10-17(9-15)13-25)21(31)27-24-30-29-22(34-24)18-4-6-19(33-3)7-5-18/h4-7,14-17,20H,8-13H2,1-3H3,(H2,26,28,32)(H,27,30,31)