N-[5-[(3-chloranyl-4-methyl-phenyl)carbamoylamino]-1,3-benzothiazol-2-yl]propanamide

Systemtic Name: N-[5-[(3-chloranyl-4-methyl-phenyl)carbamoylamino]-1,3-benzothiazol-2-yl]propanamide Openeye Name: N-[5-[(3-chloro-4-methyl-phenyl)carbamoylamino]-1,3-benzothiazol-2-yl]propanamide CAS Name: N-[5-[[(3-chloro-4-methylanilino)-oxomethyl]amino]-1,3-benzothiazol-2-yl]propanamide IUPAC Name: N-[5-[(3-chloro-4-methylphenyl)carbamoylamino]-1,3-benzothiazol-2-yl]propanamide Traditional Name: N-[5-[(3-chloro-4-methyl-phenyl)carbamoylamino]-1,3-benzothiazol-2-yl]propionamide Formula: C18H17ClN4O2S MolecularWeight: 388.87118

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Descriptors Computed from Structure

Canonical SMILES:

CCC(=O)NC1=NC2=C(S1)C=CC(=C2)NC(=O)NC3=CC(=C(C=C3)C)Cl

Isomeric SMILES

CCC(=O)NC1=NC2=C(S1)C=CC(=C2)NC(=O)NC3=CC(=C(C=C3)C)Cl

InChI

InChI=1S/C18H17ClN4O2S/c1-3-16(24)23-18-22-14-9-12(6-7-15(14)26-18)21-17(25)20-11-5-4-10(2)13(19)8-11/h4-9H,3H2,1-2H3,(H2,20,21,25)(H,22,23,24)