3-(2-chloranyl-5-morpholin-4-ylsulfonyl-phenyl)-1-(phenylmethyl)-1-propan-2-yl-thiourea

Systemtic Name: 3-(2-chloranyl-5-morpholin-4-ylsulfonyl-phenyl)-1-(phenylmethyl)-1-propan-2-yl-thiourea Openeye Name: 1-benzyl-3-(2-chloro-5-morpholinosulfonyl-phenyl)-1-isopropyl-thiourea CAS Name: 3-[2-chloro-5-(4-morpholinylsulfonyl)phenyl]-1-(phenylmethyl)-1-propan-2-ylthiourea IUPAC Name: 1-benzyl-3-(2-chloro-5-morpholin-4-ylsulfonylphenyl)-1-propan-2-ylthiourea Traditional Name: 1-benzyl-3-(2-chloro-5-morpholinosulfonyl-phenyl)-1-isopropyl-thiourea Formula: C21H26ClN3O3S2 MolecularWeight: 468.03244

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)N(CC1=CC=CC=C1)C(=S)NC2=C(C=CC(=C2)S(=O)(=O)N3CCOCC3)Cl

Isomeric SMILES

CC(C)N(CC1=CC=CC=C1)C(=S)NC2=C(C=CC(=C2)S(=O)(=O)N3CCOCC3)Cl

InChI

InChI=1S/C21H26ClN3O3S2/c1-16(2)25(15-17-6-4-3-5-7-17)21(29)23-20-14-18(8-9-19(20)22)30(26,27)24-10-12-28-13-11-24/h3-9,14,16H,10-13,15H2,1-2H3,(H,23,29)