[2-[[3-(carbamothioylamino)phenyl]methyl]phenyl]methylcarbamic acid

Systemtic Name: [2-[[3-(carbamothioylamino)phenyl]methyl]phenyl]methylcarbamic acid Openeye Name: [2-[[3-(carbamothioylamino)phenyl]methyl]phenyl]methylcarbamic acid CAS Name: [2-[[3-(carbamothioylamino)phenyl]methyl]phenyl]methylcarbamic acid IUPAC Name: [2-[[3-(carbamothioylamino)phenyl]methyl]phenyl]methylcarbamic acid Traditional Name: [2-(3-thioureidobenzyl)benzyl]carbamic acid Formula: C16H17N3O2S MolecularWeight: 315.39008

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)CC2=CC(=CC=C2)NC(=S)N)CNC(=O)O

Isomeric SMILES

C1=CC=C(C(=C1)CC2=CC(=CC=C2)NC(=S)N)CNC(=O)O

InChI

InChI=1S/C16H17N3O2S/c17-15(22)19-14-7-3-4-11(9-14)8-12-5-1-2-6-13(12)10-18-16(20)21/h1-7,9,18H,8,10H2,(H,20,21)(H3,17,19,22)