1-[[5-chloranyl-3-methyl-1-(phenylmethyl)pyrazol-4-yl]carbonylamino]-3-(3-methoxypropyl)-1-methyl-thiourea

Systemtic Name: 1-[[5-chloranyl-3-methyl-1-(phenylmethyl)pyrazol-4-yl]carbonylamino]-3-(3-methoxypropyl)-1-methyl-thiourea Openeye Name: 1-[(1-benzyl-5-chloro-3-methyl-pyrazole-4-carbonyl)amino]-3-(3-methoxypropyl)-1-methyl-thiourea CAS Name: 1-[[[5-chloro-3-methyl-1-(phenylmethyl)-4-pyrazolyl]-oxomethyl]amino]-3-(3-methoxypropyl)-1-methylthiourea IUPAC Name: 1-[(1-benzyl-5-chloro-3-methylpyrazole-4-carbonyl)amino]-3-(3-methoxypropyl)-1-methylthiourea Traditional Name: 1-[(1-benzyl-5-chloro-3-methyl-pyrazole-4-carbonyl)amino]-3-(3-methoxypropyl)-1-methyl-thiourea Formula: C18H24ClN5O2S MolecularWeight: 409.93346

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C(=C1C(=O)NN(C)C(=S)NCCCOC)Cl)CC2=CC=CC=C2

Isomeric SMILES

CC1=NN(C(=C1C(=O)NN(C)C(=S)NCCCOC)Cl)CC2=CC=CC=C2

InChI

InChI=1S/C18H24ClN5O2S/c1-13-15(16(19)24(21-13)12-14-8-5-4-6-9-14)17(25)22-23(2)18(27)20-10-7-11-26-3/h4-6,8-9H,7,10-12H2,1-3H3,(H,20,27)(H,22,25)