1-[[5-(1,3-benzothiazol-2-yl)furan-2-yl]methyl]-3-[(4-methoxyphenyl)methyl]thiourea

Systemtic Name: 1-[[5-(1,3-benzothiazol-2-yl)furan-2-yl]methyl]-3-[(4-methoxyphenyl)methyl]thiourea Openeye Name: 1-[[5-(1,3-benzothiazol-2-yl)-2-furyl]methyl]-3-[(4-methoxyphenyl)methyl]thiourea CAS Name: 1-[[5-(1,3-benzothiazol-2-yl)-2-furanyl]methyl]-3-[(4-methoxyphenyl)methyl]thiourea IUPAC Name: 1-[[5-(1,3-benzothiazol-2-yl)furan-2-yl]methyl]-3-[(4-methoxyphenyl)methyl]thiourea Traditional Name: 1-[[5-(1,3-benzothiazol-2-yl)-2-furyl]methyl]-3-p-anisyl-thiourea Formula: C21H19N3O2S2 MolecularWeight: 409.52446

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)CNC(=S)NCC2=CC=C(O2)C3=NC4=CC=CC=C4S3

Isomeric SMILES

COC1=CC=C(C=C1)CNC(=S)NCC2=CC=C(O2)C3=NC4=CC=CC=C4S3

InChI

InChI=1S/C21H19N3O2S2/c1-25-15-8-6-14(7-9-15)12-22-21(27)23-13-16-10-11-18(26-16)20-24-17-4-2-3-5-19(17)28-20/h2-11H,12-13H2,1H3,(H2,22,23,27)