1-[[4-[2-morpholin-4-ylethyl(pyridin-4-ylmethyl)amino]-1,3-thiazet-2-ylidene]amino]propan-2-one

Systemtic Name: 1-[[4-[2-morpholin-4-ylethyl(pyridin-4-ylmethyl)amino]-1,3-thiazet-2-ylidene]amino]propan-2-one Openeye Name: 1-[[4-[2-morpholinoethyl(4-pyridylmethyl)amino]-1,3-thiazet-2-ylidene]amino]propan-2-one CAS Name: 1-[[4-[2-(4-morpholinyl)ethyl-(pyridin-4-ylmethyl)amino]-1,3-thiazet-2-ylidene]amino]-2-propanone IUPAC Name: 1-[[4-[2-morpholin-4-ylethyl(pyridin-4-ylmethyl)amino]-1,3-thiazet-2-ylidene]amino]propan-2-one Traditional Name: 1-[[4-[2-morpholinoethyl(4-pyridylmethyl)amino]-1,3-thiazet-2-ylidene]amino]acetone Formula: C17H23N5O2S MolecularWeight: 361.46182

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(=O)CN=C1N=C(S1)N(CCN2CCOCC2)CC3=CC=NC=C3

Isomeric SMILES

CC(=O)CN=C1N=C(S1)N(CCN2CCOCC2)CC3=CC=NC=C3

InChI

InChI=1S/C17H23N5O2S/c1-14(23)12-19-16-20-17(25-16)22(13-15-2-4-18-5-3-15)7-6-21-8-10-24-11-9-21/h2-5H,6-13H2,1H3