1-[(E)-(1-methylpyrrol-2-yl)methylideneamino]-3-(4-octoxyphenyl)urea

Systemtic Name: 1-[(E)-(1-methylpyrrol-2-yl)methylideneamino]-3-(4-octoxyphenyl)urea Openeye Name: 1-[(E)-(1-methylpyrrol-2-yl)methyleneamino]-3-(4-octoxyphenyl)urea CAS Name: 1-[(E)-(1-methyl-2-pyrrolyl)methylideneamino]-3-(4-octoxyphenyl)urea IUPAC Name: 1-[(E)-(1-methylpyrrol-2-yl)methylideneamino]-3-(4-octoxyphenyl)urea Traditional Name: 1-[(E)-(1-methylpyrrol-2-yl)methyleneamino]-3-(4-octoxyphenyl)urea Formula: C21H30N4O2 MolecularWeight: 370.4885

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCOC1=CC=C(C=C1)NC(=O)NN=CC2=CC=CN2C

Isomeric SMILES

CCCCCCCCOC1=CC=C(C=C1)NC(=O)N/N=C/C2=CC=CN2C

InChI

InChI=1S/C21H30N4O2/c1-3-4-5-6-7-8-16-27-20-13-11-18(12-14-20)23-21(26)24-22-17-19-10-9-15-25(19)2/h9-15,17H,3-8,16H2,1-2H3,(H2,23,24,26)/b22-17+