N'-[4-[4-[(3,5-dibutoxy-4-oxidanyl-phenyl)methyl]piperazin-1-yl]phenyl]thiophene-2-carboximidamide

Systemtic Name: N'-[4-[4-[(3,5-dibutoxy-4-oxidanyl-phenyl)methyl]piperazin-1-yl]phenyl]thiophene-2-carboximidamide Openeye Name: N'-[4-[4-[(3,5-dibutoxy-4-hydroxy-phenyl)methyl]piperazin-1-yl]phenyl]thiophene-2-carboxamidine CAS Name: N'-[4-[4-[(3,5-dibutoxy-4-hydroxyphenyl)methyl]-1-piperazinyl]phenyl]-2-thiophenecarboximidamide IUPAC Name: N'-[4-[4-[(3,5-dibutoxy-4-hydroxyphenyl)methyl]piperazin-1-yl]phenyl]thiophene-2-carboximidamide Traditional Name: N'-[4-[4-(3,5-dibutoxy-4-hydroxy-benzyl)piperazino]phenyl]thiophene-2-carboxamidine Formula: C30H40N4O3S MolecularWeight: 536.7286

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=CC(=CC(=C1O)OCCCC)CN2CCN(CC2)C3=CC=C(C=C3)N=C(C4=CC=CS4)N

Isomeric SMILES

CCCCOC1=CC(=CC(=C1O)OCCCC)CN2CCN(CC2)C3=CC=C(C=C3)N=C(C4=CC=CS4)N

InChI

InChI=1S/C30H40N4O3S/c1-3-5-17-36-26-20-23(21-27(29(26)35)37-18-6-4-2)22-33-13-15-34(16-14-33)25-11-9-24(10-12-25)32-30(31)28-8-7-19-38-28/h7-12,19-21,35H,3-6,13-18,22H2,1-2H3,(H2,31,32)