N-(2-chloranyl-6-methyl-phenyl)-2-(1-phenylpropylcarbamoylamino)-1,3-benzothiazole-6-carboxamide

Systemtic Name: N-(2-chloranyl-6-methyl-phenyl)-2-(1-phenylpropylcarbamoylamino)-1,3-benzothiazole-6-carboxamide Openeye Name: N-(2-chloro-6-methyl-phenyl)-2-(1-phenylpropylcarbamoylamino)-1,3-benzothiazole-6-carboxamide CAS Name: N-(2-chloro-6-methylphenyl)-2-[[oxo-(1-phenylpropylamino)methyl]amino]-1,3-benzothiazole-6-carboxamide IUPAC Name: N-(2-chloro-6-methylphenyl)-2-(1-phenylpropylcarbamoylamino)-1,3-benzothiazole-6-carboxamide Traditional Name: N-(2-chloro-6-methyl-phenyl)-2-(1-phenylpropylcarbamoylamino)-1,3-benzothiazole-6-carboxamide Formula: C25H23ClN4O2S MolecularWeight: 478.99372

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C1=CC=CC=C1)NC(=O)NC2=NC3=C(S2)C=C(C=C3)C(=O)NC4=C(C=CC=C4Cl)C

Isomeric SMILES

CCC(C1=CC=CC=C1)NC(=O)NC2=NC3=C(S2)C=C(C=C3)C(=O)NC4=C(C=CC=C4Cl)C

InChI

InChI=1S/C25H23ClN4O2S/c1-3-19(16-9-5-4-6-10-16)27-24(32)30-25-28-20-13-12-17(14-21(20)33-25)23(31)29-22-15(2)8-7-11-18(22)26/h4-14,19H,3H2,1-2H3,(H,29,31)(H2,27,28,30,32)