1-(3-chloranyl-4-methyl-phenyl)-3-[4-(pyrrolidin-1-ylmethyl)-1,3-thiazol-2-yl]urea

Systemtic Name: 1-(3-chloranyl-4-methyl-phenyl)-3-[4-(pyrrolidin-1-ylmethyl)-1,3-thiazol-2-yl]urea Openeye Name: 1-(3-chloro-4-methyl-phenyl)-3-[4-(pyrrolidin-1-ylmethyl)thiazol-2-yl]urea CAS Name: 1-(3-chloro-4-methylphenyl)-3-[4-(1-pyrrolidinylmethyl)-2-thiazolyl]urea IUPAC Name: 1-(3-chloro-4-methylphenyl)-3-[4-(pyrrolidin-1-ylmethyl)-1,3-thiazol-2-yl]urea Traditional Name: 1-(3-chloro-4-methyl-phenyl)-3-[4-(pyrrolidinomethyl)thiazol-2-yl]urea Formula: C16H19ClN4OS MolecularWeight: 350.86626

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)NC(=O)NC2=NC(=CS2)CN3CCCC3)Cl

Isomeric SMILES

CC1=C(C=C(C=C1)NC(=O)NC2=NC(=CS2)CN3CCCC3)Cl

InChI

InChI=1S/C16H19ClN4OS/c1-11-4-5-12(8-14(11)17)18-15(22)20-16-19-13(10-23-16)9-21-6-2-3-7-21/h4-5,8,10H,2-3,6-7,9H2,1H3,(H2,18,19,20,22)