1-[(5-methylthiophen-2-yl)methyl]-3-[6-(3-oxidanylidenepiperazin-1-yl)pyridin-3-yl]urea

Systemtic Name: 1-[(5-methylthiophen-2-yl)methyl]-3-[6-(3-oxidanylidenepiperazin-1-yl)pyridin-3-yl]urea Openeye Name: 1-[(5-methyl-2-thienyl)methyl]-3-[6-(3-oxopiperazin-1-yl)-3-pyridyl]urea CAS Name: 1-[(5-methyl-2-thiophenyl)methyl]-3-[6-(3-oxo-1-piperazinyl)-3-pyridinyl]urea IUPAC Name: 1-[(5-methylthiophen-2-yl)methyl]-3-[6-(3-oxopiperazin-1-yl)pyridin-3-yl]urea Traditional Name: 1-[6-(3-ketopiperazino)-3-pyridyl]-3-[(5-methyl-2-thienyl)methyl]urea Formula: C16H19N5O2S MolecularWeight: 345.41936

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(S1)CNC(=O)NC2=CN=C(C=C2)N3CCNC(=O)C3

Isomeric SMILES

CC1=CC=C(S1)CNC(=O)NC2=CN=C(C=C2)N3CCNC(=O)C3

InChI

InChI=1S/C16H19N5O2S/c1-11-2-4-13(24-11)9-19-16(23)20-12-3-5-14(18-8-12)21-7-6-17-15(22)10-21/h2-5,8H,6-7,9-10H2,1H3,(H,17,22)(H2,19,20,23)