N-(1,3-benzothiazol-2-ylmethyl)-4-(cyclohexylcarbamoylamino)-N-methyl-butanamide

Systemtic Name: N-(1,3-benzothiazol-2-ylmethyl)-4-(cyclohexylcarbamoylamino)-N-methyl-butanamide Openeye Name: N-(1,3-benzothiazol-2-ylmethyl)-4-(cyclohexylcarbamoylamino)-N-methyl-butanamide CAS Name: N-(1,3-benzothiazol-2-ylmethyl)-4-[[(cyclohexylamino)-oxomethyl]amino]-N-methylbutanamide IUPAC Name: N-(1,3-benzothiazol-2-ylmethyl)-4-(cyclohexylcarbamoylamino)-N-methylbutanamide Traditional Name: N-(1,3-benzothiazol-2-ylmethyl)-4-(cyclohexylcarbamoylamino)-N-methyl-butyramide Formula: C20H28N4O2S MolecularWeight: 388.52692

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Descriptors Computed from Structure

Canonical SMILES:

CN(CC1=NC2=CC=CC=C2S1)C(=O)CCCNC(=O)NC3CCCCC3

Isomeric SMILES

CN(CC1=NC2=CC=CC=C2S1)C(=O)CCCNC(=O)NC3CCCCC3

InChI

InChI=1S/C20H28N4O2S/c1-24(14-18-23-16-10-5-6-11-17(16)27-18)19(25)12-7-13-21-20(26)22-15-8-3-2-4-9-15/h5-6,10-11,15H,2-4,7-9,12-14H2,1H3,(H2,21,22,26)