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

Systemtic Name: 2-(4-chloranylbutanoylamino)-N-[5-(4-methoxyphenyl)-1,3,4-thiadiazol-2-yl]-3-methyl-butanamide Openeye Name: 2-(4-chlorobutanoylamino)-N-[5-(4-methoxyphenyl)-1,3,4-thiadiazol-2-yl]-3-methyl-butanamide CAS Name: 2-[(4-chloro-1-oxobutyl)amino]-N-[5-(4-methoxyphenyl)-1,3,4-thiadiazol-2-yl]-3-methylbutanamide IUPAC Name: 2-(4-chlorobutanoylamino)-N-[5-(4-methoxyphenyl)-1,3,4-thiadiazol-2-yl]-3-methylbutanamide Traditional Name: 2-(4-chlorobutanoylamino)-N-[5-(4-methoxyphenyl)-1,3,4-thiadiazol-2-yl]-3-methyl-butyramide Formula: C18H23ClN4O3S MolecularWeight: 410.91822

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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)CCCCl

Isomeric SMILES

CC(C)C(C(=O)NC1=NN=C(S1)C2=CC=C(C=C2)OC)NC(=O)CCCCl

InChI

InChI=1S/C18H23ClN4O3S/c1-11(2)15(20-14(24)5-4-10-19)16(25)21-18-23-22-17(27-18)12-6-8-13(26-3)9-7-12/h6-9,11,15H,4-5,10H2,1-3H3,(H,20,24)(H,21,23,25)