1,3-bis(3-pyrrol-1-yl-1-benzothiophen-2-yl)urea

Systemtic Name: 1,3-bis(3-pyrrol-1-yl-1-benzothiophen-2-yl)urea Openeye Name: 1,3-bis(3-pyrrol-1-ylbenzothiophen-2-yl)urea CAS Name: 1,3-bis[3-(1-pyrrolyl)-1-benzothiophen-2-yl]urea IUPAC Name: 1,3-bis(3-pyrrol-1-yl-1-benzothiophen-2-yl)urea Traditional Name: 1,3-bis(3-pyrrol-1-ylbenzothiophen-2-yl)urea Formula: C25H18N4OS2 MolecularWeight: 454.56662

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=C(S2)NC(=O)NC3=C(C4=CC=CC=C4S3)N5C=CC=C5)N6C=CC=C6

Isomeric SMILES

C1=CC=C2C(=C1)C(=C(S2)NC(=O)NC3=C(C4=CC=CC=C4S3)N5C=CC=C5)N6C=CC=C6

InChI

InChI=1S/C25H18N4OS2/c30-25(26-23-21(28-13-5-6-14-28)17-9-1-3-11-19(17)31-23)27-24-22(29-15-7-8-16-29)18-10-2-4-12-20(18)32-24/h1-16H,(H2,26,27,30)