N-[4-(6-methyl-1,3-benzothiazol-2-yl)phenyl]-N'-(1,3-thiazol-2-yl)butanediamide

Systemtic Name: N-[4-(6-methyl-1,3-benzothiazol-2-yl)phenyl]-N'-(1,3-thiazol-2-yl)butanediamide Openeye Name: N-[4-(6-methyl-1,3-benzothiazol-2-yl)phenyl]-N'-thiazol-2-yl-butanediamide CAS Name: N-[4-(6-methyl-1,3-benzothiazol-2-yl)phenyl]-N'-(2-thiazolyl)butanediamide IUPAC Name: N-[4-(6-methyl-1,3-benzothiazol-2-yl)phenyl]-N'-(1,3-thiazol-2-yl)butanediamide Traditional Name: N-[4-(6-methyl-1,3-benzothiazol-2-yl)phenyl]-N'-thiazol-2-yl-succinamide Formula: C21H18N4O2S2 MolecularWeight: 422.52322

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)N=C(S2)C3=CC=C(C=C3)NC(=O)CCC(=O)NC4=NC=CS4

Isomeric SMILES

CC1=CC2=C(C=C1)N=C(S2)C3=CC=C(C=C3)NC(=O)CCC(=O)NC4=NC=CS4

InChI

InChI=1S/C21H18N4O2S2/c1-13-2-7-16-17(12-13)29-20(24-16)14-3-5-15(6-4-14)23-18(26)8-9-19(27)25-21-22-10-11-28-21/h2-7,10-12H,8-9H2,1H3,(H,23,26)(H,22,25,27)