2-(aminocarbonylamino)-4-methylsulfanyl-N-(2-methylsulfanyl-1,3-benzothiazol-6-yl)butanamide

Systemtic Name: 2-(aminocarbonylamino)-4-methylsulfanyl-N-(2-methylsulfanyl-1,3-benzothiazol-6-yl)butanamide Openeye Name: 4-methylsulfanyl-N-(2-methylsulfanyl-1,3-benzothiazol-6-yl)-2-ureido-butanamide CAS Name: 2-(carbamoylamino)-4-(methylthio)-N-[2-(methylthio)-1,3-benzothiazol-6-yl]butanamide IUPAC Name: 2-(carbamoylamino)-4-methylsulfanyl-N-(2-methylsulfanyl-1,3-benzothiazol-6-yl)butanamide Traditional Name: 4-(methylthio)-N-[2-(methylthio)-1,3-benzothiazol-6-yl]-2-ureido-butyramide Formula: C14H18N4O2S3 MolecularWeight: 370.51332

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Descriptors Computed from Structure

Canonical SMILES:

CSCCC(C(=O)NC1=CC2=C(C=C1)N=C(S2)SC)NC(=O)N

Isomeric SMILES

CSCCC(C(=O)NC1=CC2=C(C=C1)N=C(S2)SC)NC(=O)N

InChI

InChI=1S/C14H18N4O2S3/c1-21-6-5-10(17-13(15)20)12(19)16-8-3-4-9-11(7-8)23-14(18-9)22-2/h3-4,7,10H,5-6H2,1-2H3,(H,16,19)(H3,15,17,20)