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

Systemtic Name: N-[4-methyl-6-[(4-methylphenyl)methylcarbamoylamino]-1,3-benzothiazol-2-yl]propanamide Openeye Name: N-[4-methyl-6-(p-tolylmethylcarbamoylamino)-1,3-benzothiazol-2-yl]propanamide CAS Name: N-[4-methyl-6-[[[(4-methylphenyl)methylamino]-oxomethyl]amino]-1,3-benzothiazol-2-yl]propanamide IUPAC Name: N-[4-methyl-6-[(4-methylphenyl)methylcarbamoylamino]-1,3-benzothiazol-2-yl]propanamide Traditional Name: N-[4-methyl-6-[(4-methylbenzyl)carbamoylamino]-1,3-benzothiazol-2-yl]propionamide Formula: C20H22N4O2S MolecularWeight: 382.47928

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Descriptors Computed from Structure

Canonical SMILES:

CCC(=O)NC1=NC2=C(S1)C=C(C=C2C)NC(=O)NCC3=CC=C(C=C3)C

Isomeric SMILES

CCC(=O)NC1=NC2=C(S1)C=C(C=C2C)NC(=O)NCC3=CC=C(C=C3)C

InChI

InChI=1S/C20H22N4O2S/c1-4-17(25)23-20-24-18-13(3)9-15(10-16(18)27-20)22-19(26)21-11-14-7-5-12(2)6-8-14/h5-10H,4,11H2,1-3H3,(H2,21,22,26)(H,23,24,25)