1-[2-methoxy-5-(phenylsulfonyl)phenyl]-3-(phenylmethyl)thiourea

Systemtic Name: 1-[2-methoxy-5-(phenylsulfonyl)phenyl]-3-(phenylmethyl)thiourea Openeye Name: 1-[5-(benzenesulfonyl)-2-methoxy-phenyl]-3-benzyl-thiourea CAS Name: 1-[5-(benzenesulfonyl)-2-methoxyphenyl]-3-(phenylmethyl)thiourea IUPAC Name: 1-[5-(benzenesulfonyl)-2-methoxyphenyl]-3-benzylthiourea Traditional Name: 1-benzyl-3-(5-besyl-2-methoxy-phenyl)thiourea Formula: C21H20N2O3S2 MolecularWeight: 412.5251

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)S(=O)(=O)C2=CC=CC=C2)NC(=S)NCC3=CC=CC=C3

Isomeric SMILES

COC1=C(C=C(C=C1)S(=O)(=O)C2=CC=CC=C2)NC(=S)NCC3=CC=CC=C3

InChI

InChI=1S/C21H20N2O3S2/c1-26-20-13-12-18(28(24,25)17-10-6-3-7-11-17)14-19(20)23-21(27)22-15-16-8-4-2-5-9-16/h2-14H,15H2,1H3,(H2,22,23,27)