1-(1,3-benzothiazol-2-ylmethyl)-1-methyl-3-[[4-(1,2,4-triazol-1-ylmethyl)phenyl]methyl]urea

Systemtic Name: 1-(1,3-benzothiazol-2-ylmethyl)-1-methyl-3-[[4-(1,2,4-triazol-1-ylmethyl)phenyl]methyl]urea Openeye Name: 1-(1,3-benzothiazol-2-ylmethyl)-1-methyl-3-[[4-(1,2,4-triazol-1-ylmethyl)phenyl]methyl]urea CAS Name: 1-(1,3-benzothiazol-2-ylmethyl)-1-methyl-3-[[4-(1,2,4-triazol-1-ylmethyl)phenyl]methyl]urea IUPAC Name: 1-(1,3-benzothiazol-2-ylmethyl)-1-methyl-3-[[4-(1,2,4-triazol-1-ylmethyl)phenyl]methyl]urea Traditional Name: 1-(1,3-benzothiazol-2-ylmethyl)-1-methyl-3-[4-(1,2,4-triazol-1-ylmethyl)benzyl]urea Formula: C20H20N6OS MolecularWeight: 392.4774

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Descriptors Computed from Structure

Canonical SMILES:

CN(CC1=NC2=CC=CC=C2S1)C(=O)NCC3=CC=C(C=C3)CN4C=NC=N4

Isomeric SMILES

CN(CC1=NC2=CC=CC=C2S1)C(=O)NCC3=CC=C(C=C3)CN4C=NC=N4

InChI

InChI=1S/C20H20N6OS/c1-25(12-19-24-17-4-2-3-5-18(17)28-19)20(27)22-10-15-6-8-16(9-7-15)11-26-14-21-13-23-26/h2-9,13-14H,10-12H2,1H3,(H,22,27)