1-phenethyl-3-[[4-(phenylsulfonyl)phenyl]carbonylamino]thiourea

Systemtic Name: 1-phenethyl-3-[[4-(phenylsulfonyl)phenyl]carbonylamino]thiourea Openeye Name: 1-[[4-(benzenesulfonyl)benzoyl]amino]-3-phenethyl-thiourea CAS Name: 1-[[[4-(benzenesulfonyl)phenyl]-oxomethyl]amino]-3-phenethylthiourea IUPAC Name: 1-[[4-(benzenesulfonyl)benzoyl]amino]-3-phenethylthiourea Traditional Name: 1-[(4-besylbenzoyl)amino]-3-phenethyl-thiourea Formula: C22H21N3O3S2 MolecularWeight: 439.55044

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CCNC(=S)NNC(=O)C2=CC=C(C=C2)S(=O)(=O)C3=CC=CC=C3

Isomeric SMILES

C1=CC=C(C=C1)CCNC(=S)NNC(=O)C2=CC=C(C=C2)S(=O)(=O)C3=CC=CC=C3

InChI

InChI=1S/C22H21N3O3S2/c26-21(24-25-22(29)23-16-15-17-7-3-1-4-8-17)18-11-13-20(14-12-18)30(27,28)19-9-5-2-6-10-19/h1-14H,15-16H2,(H,24,26)(H2,23,25,29)