1-[2-(1,3-benzothiazol-2-ylamino)ethyl]-3-(pyridin-4-ylmethyl)urea

Systemtic Name: 1-[2-(1,3-benzothiazol-2-ylamino)ethyl]-3-(pyridin-4-ylmethyl)urea Openeye Name: 1-[2-(1,3-benzothiazol-2-ylamino)ethyl]-3-(4-pyridylmethyl)urea CAS Name: 1-[2-(1,3-benzothiazol-2-ylamino)ethyl]-3-(pyridin-4-ylmethyl)urea IUPAC Name: 1-[2-(1,3-benzothiazol-2-ylamino)ethyl]-3-(pyridin-4-ylmethyl)urea Traditional Name: 1-[2-(1,3-benzothiazol-2-ylamino)ethyl]-3-(4-pyridylmethyl)urea Formula: C16H17N5OS MolecularWeight: 327.40408

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)N=C(S2)NCCNC(=O)NCC3=CC=NC=C3

Isomeric SMILES

C1=CC=C2C(=C1)N=C(S2)NCCNC(=O)NCC3=CC=NC=C3

InChI

InChI=1S/C16H17N5OS/c22-15(20-11-12-5-7-17-8-6-12)18-9-10-19-16-21-13-3-1-2-4-14(13)23-16/h1-8H,9-11H2,(H,19,21)(H2,18,20,22)