2-[(E)-3-[1-[3-(butylamino)-4-methyl-phenyl]-4-methyl-pyrrol-2-yl]propylideneamino]guanidine

Systemtic Name: 2-[(E)-3-[1-[3-(butylamino)-4-methyl-phenyl]-4-methyl-pyrrol-2-yl]propylideneamino]guanidine Openeye Name: 2-[(E)-3-[1-[3-(butylamino)-4-methyl-phenyl]-4-methyl-pyrrol-2-yl]propylideneamino]guanidine CAS Name: 2-[(E)-3-[1-[3-(butylamino)-4-methylphenyl]-4-methyl-2-pyrrolyl]propylideneamino]guanidine IUPAC Name: 2-[(E)-3-[1-[3-(butylamino)-4-methylphenyl]-4-methylpyrrol-2-yl]propylideneamino]guanidine Traditional Name: 2-[(E)-3-[1-[3-(butylamino)-4-methyl-phenyl]-4-methyl-pyrrol-2-yl]propylideneamino]guanidine Formula: C20H30N6 MolecularWeight: 354.4924

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Descriptors Computed from Structure

Canonical SMILES:

CCCCNC1=C(C=CC(=C1)N2C=C(C=C2CCC=NN=C(N)N)C)C

Isomeric SMILES

CCCCNC1=C(C=CC(=C1)N2C=C(C=C2CC/C=N/N=C(N)N)C)C

InChI

InChI=1S/C20H30N6/c1-4-5-10-23-19-13-18(9-8-16(19)3)26-14-15(2)12-17(26)7-6-11-24-25-20(21)22/h8-9,11-14,23H,4-7,10H2,1-3H3,(H4,21,22,25)/b24-11+