1-(1,3-benzothiazol-2-yl)-3-[(2-pyrrol-1-ylthiophen-3-yl)methyl]urea

Systemtic Name: 1-(1,3-benzothiazol-2-yl)-3-[(2-pyrrol-1-ylthiophen-3-yl)methyl]urea Openeye Name: 1-(1,3-benzothiazol-2-yl)-3-[(2-pyrrol-1-yl-3-thienyl)methyl]urea CAS Name: 1-(1,3-benzothiazol-2-yl)-3-[[2-(1-pyrrolyl)-3-thiophenyl]methyl]urea IUPAC Name: 1-(1,3-benzothiazol-2-yl)-3-[(2-pyrrol-1-ylthiophen-3-yl)methyl]urea Traditional Name: 1-(1,3-benzothiazol-2-yl)-3-[(2-pyrrol-1-yl-3-thienyl)methyl]urea Formula: C17H14N4OS2 MolecularWeight: 354.44926

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)N=C(S2)NC(=O)NCC3=C(SC=C3)N4C=CC=C4

Isomeric SMILES

C1=CC=C2C(=C1)N=C(S2)NC(=O)NCC3=C(SC=C3)N4C=CC=C4

InChI

InChI=1S/C17H14N4OS2/c22-16(20-17-19-13-5-1-2-6-14(13)24-17)18-11-12-7-10-23-15(12)21-8-3-4-9-21/h1-10H,11H2,(H2,18,19,20,22)