1-[(3-methylthiophen-2-yl)methyl]-3-[(2-pyrrolidin-1-ylpyridin-4-yl)methyl]urea

Systemtic Name: 1-[(3-methylthiophen-2-yl)methyl]-3-[(2-pyrrolidin-1-ylpyridin-4-yl)methyl]urea Openeye Name: 1-[(3-methyl-2-thienyl)methyl]-3-[(2-pyrrolidin-1-yl-4-pyridyl)methyl]urea CAS Name: 1-[(3-methyl-2-thiophenyl)methyl]-3-[[2-(1-pyrrolidinyl)-4-pyridinyl]methyl]urea IUPAC Name: 1-[(3-methylthiophen-2-yl)methyl]-3-[(2-pyrrolidin-1-ylpyridin-4-yl)methyl]urea Traditional Name: 1-[(3-methyl-2-thienyl)methyl]-3-[(2-pyrrolidino-4-pyridyl)methyl]urea Formula: C17H22N4OS MolecularWeight: 330.44778

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC=C1)CNC(=O)NCC2=CC(=NC=C2)N3CCCC3

Isomeric SMILES

CC1=C(SC=C1)CNC(=O)NCC2=CC(=NC=C2)N3CCCC3

InChI

InChI=1S/C17H22N4OS/c1-13-5-9-23-15(13)12-20-17(22)19-11-14-4-6-18-16(10-14)21-7-2-3-8-21/h4-6,9-10H,2-3,7-8,11-12H2,1H3,(H2,19,20,22)