N-[2-(1,3-benzothiazol-2-ylamino)ethyl]-3-(1,3,5-trimethylpyrazol-4-yl)propanamide

Systemtic Name: N-[2-(1,3-benzothiazol-2-ylamino)ethyl]-3-(1,3,5-trimethylpyrazol-4-yl)propanamide Openeye Name: N-[2-(1,3-benzothiazol-2-ylamino)ethyl]-3-(1,3,5-trimethylpyrazol-4-yl)propanamide CAS Name: N-[2-(1,3-benzothiazol-2-ylamino)ethyl]-3-(1,3,5-trimethyl-4-pyrazolyl)propanamide IUPAC Name: N-[2-(1,3-benzothiazol-2-ylamino)ethyl]-3-(1,3,5-trimethylpyrazol-4-yl)propanamide Traditional Name: N-[2-(1,3-benzothiazol-2-ylamino)ethyl]-3-(1,3,5-trimethylpyrazol-4-yl)propionamide Formula: C18H23N5OS MolecularWeight: 357.47312

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1C)C)CCC(=O)NCCNC2=NC3=CC=CC=C3S2

Isomeric SMILES

CC1=C(C(=NN1C)C)CCC(=O)NCCNC2=NC3=CC=CC=C3S2

InChI

InChI=1S/C18H23N5OS/c1-12-14(13(2)23(3)22-12)8-9-17(24)19-10-11-20-18-21-15-6-4-5-7-16(15)25-18/h4-7H,8-11H2,1-3H3,(H,19,24)(H,20,21)