3-[2-(cyclohexylcarbamoylamino)-1,3-thiazol-4-yl]-N-(6-methyl-1,3-benzothiazol-2-yl)propanamide

Systemtic Name: 3-[2-(cyclohexylcarbamoylamino)-1,3-thiazol-4-yl]-N-(6-methyl-1,3-benzothiazol-2-yl)propanamide Openeye Name: 3-[2-(cyclohexylcarbamoylamino)thiazol-4-yl]-N-(6-methyl-1,3-benzothiazol-2-yl)propanamide CAS Name: 3-[2-[[(cyclohexylamino)-oxomethyl]amino]-4-thiazolyl]-N-(6-methyl-1,3-benzothiazol-2-yl)propanamide IUPAC Name: 3-[2-(cyclohexylcarbamoylamino)-1,3-thiazol-4-yl]-N-(6-methyl-1,3-benzothiazol-2-yl)propanamide Traditional Name: 3-[2-(cyclohexylcarbamoylamino)thiazol-4-yl]-N-(6-methyl-1,3-benzothiazol-2-yl)propionamide Formula: C21H25N5O2S2 MolecularWeight: 443.5855

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)N=C(S2)NC(=O)CCC3=CSC(=N3)NC(=O)NC4CCCCC4

Isomeric SMILES

CC1=CC2=C(C=C1)N=C(S2)NC(=O)CCC3=CSC(=N3)NC(=O)NC4CCCCC4

InChI

InChI=1S/C21H25N5O2S2/c1-13-7-9-16-17(11-13)30-21(24-16)25-18(27)10-8-15-12-29-20(23-15)26-19(28)22-14-5-3-2-4-6-14/h7,9,11-12,14H,2-6,8,10H2,1H3,(H,24,25,27)(H2,22,23,26,28)