1-[3-[5-(4-pyrrol-1-ylphenoxy)pentoxy]phenyl]thiourea

Systemtic Name: 1-[3-[5-(4-pyrrol-1-ylphenoxy)pentoxy]phenyl]thiourea Openeye Name: [3-[5-(4-pyrrol-1-ylphenoxy)pentoxy]phenyl]thiourea CAS Name: [3-[5-[4-(1-pyrrolyl)phenoxy]pentoxy]phenyl]thiourea IUPAC Name: [3-[5-(4-pyrrol-1-ylphenoxy)pentoxy]phenyl]thiourea Traditional Name: [3-[5-(4-pyrrol-1-ylphenoxy)pentoxy]phenyl]thiourea Formula: C22H25N3O2S MolecularWeight: 395.5178

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Descriptors Computed from Structure

Canonical SMILES:

C1=CN(C=C1)C2=CC=C(C=C2)OCCCCCOC3=CC=CC(=C3)NC(=S)N

Isomeric SMILES

C1=CN(C=C1)C2=CC=C(C=C2)OCCCCCOC3=CC=CC(=C3)NC(=S)N

InChI

InChI=1S/C22H25N3O2S/c23-22(28)24-18-7-6-8-21(17-18)27-16-5-1-4-15-26-20-11-9-19(10-12-20)25-13-2-3-14-25/h2-3,6-14,17H,1,4-5,15-16H2,(H3,23,24,28)